Pub Date : 2022-06-01DOI: 10.32362/2410-6593-2022-17-2-172-181
A. Kornilov, M. S. Grigoriev, E. Savinkina
Objectives. Currently, several hundred polyiodide compounds have been synthesized and structurally characterized, but so far, no formation patterns for certain polyiodide ions have been revealed. The purpose of this work is to continue the search for formation regularities of polyiodides, including polyiodides of lanthanide complexes.Methods. Iodide and polyiodide of samarium complexes with biuret (BU), [Sm(BU)4]I3·BU·2H2O and [Sm(BU)4][I5][I]2, were first synthesized and characterized by X-ray diffraction analysis and infrared spectroscopy, respectively.Results. The obtained compounds complement the row of isostructural lanthanide (La–Gd) complexes. Structures of corresponding iodides and polyiodides were compared in detail. Both types of the compounds contain complex cations of the same composition; however, their structures differ significantly. The central atom coordination polyhedron can be described as a distorted square antiprism and a distorted dodecahedron, respectively. Even greater differences are observed in the outer sphere of complex compounds. The iodide compound crystals contain uncoordinated iodide ions, a biuret molecule and two water molecules. In the polyiodide compound, cations together with isolated I– ions form a three-dimensional framework with the channels, in which linear I5– ions are united in infinite linear chains by weak interactions.Conclusions. The replacement of an iodide ion with a polyiodide ion in complex compounds of lanthanides with BU leads to changes in both the inner sphere and the outer sphere of the cation complex, including the supramolecular level. The presence of iodine atom infinite linear chains in polyiodides allows expecting the presence of anisotropic electrical conductivity along this direction.
{"title":"Comparison of the rare earth complexes iodides and polyiodides with biuret","authors":"A. Kornilov, M. S. Grigoriev, E. Savinkina","doi":"10.32362/2410-6593-2022-17-2-172-181","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-2-172-181","url":null,"abstract":"Objectives. Currently, several hundred polyiodide compounds have been synthesized and structurally characterized, but so far, no formation patterns for certain polyiodide ions have been revealed. The purpose of this work is to continue the search for formation regularities of polyiodides, including polyiodides of lanthanide complexes.Methods. Iodide and polyiodide of samarium complexes with biuret (BU), [Sm(BU)4]I3·BU·2H2O and [Sm(BU)4][I5][I]2, were first synthesized and characterized by X-ray diffraction analysis and infrared spectroscopy, respectively.Results. The obtained compounds complement the row of isostructural lanthanide (La–Gd) complexes. Structures of corresponding iodides and polyiodides were compared in detail. Both types of the compounds contain complex cations of the same composition; however, their structures differ significantly. The central atom coordination polyhedron can be described as a distorted square antiprism and a distorted dodecahedron, respectively. Even greater differences are observed in the outer sphere of complex compounds. The iodide compound crystals contain uncoordinated iodide ions, a biuret molecule and two water molecules. In the polyiodide compound, cations together with isolated I– ions form a three-dimensional framework with the channels, in which linear I5– ions are united in infinite linear chains by weak interactions.Conclusions. The replacement of an iodide ion with a polyiodide ion in complex compounds of lanthanides with BU leads to changes in both the inner sphere and the outer sphere of the cation complex, including the supramolecular level. The presence of iodine atom infinite linear chains in polyiodides allows expecting the presence of anisotropic electrical conductivity along this direction.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"82825115","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-06-01DOI: 10.32362/2410-6593-2022-17-2-152-163
О. А. Dulina, Е. V. Eskova, А. D. Tarasenko, S. V. Kotova
Objectives. The influence of the technological additive content and accelerated aging conditions on the surface energy and elastic-strength properties of nitrile butadiene rubbers with an average acrylic acid nitrile content and rubbers based on them were studied in the paper.Methods. The free surface energy of the samples was determined under the standard conditions and in the accelerated aging conditions with the use of the Owens, Wendt, Rabel, and Kaelble method.Results. It was shown that the elastomeric materials surface energy is influenced by surfactants such as rosin and stearic acid, which are typical ingredients of rubber compounds. It was also found that the thermal aging effect on the physical and mechanical properties of rubbers based on nitrile butadiene rubbers depends on the method of rubber isolation from latex and on the nature of the surfactant components in the samples.Conclusions. The analysis of the results obtained shows that the change in the vulcanizates physical and mechanical properties, depending on the technological additive content and the temperature effect, occurs along with a change in the critical surface tension.
{"title":"Influence of various factors on surface properties of elastomeric materials based on nitrile butadiene rubbers","authors":"О. А. Dulina, Е. V. Eskova, А. D. Tarasenko, S. V. Kotova","doi":"10.32362/2410-6593-2022-17-2-152-163","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-2-152-163","url":null,"abstract":"Objectives. The influence of the technological additive content and accelerated aging conditions on the surface energy and elastic-strength properties of nitrile butadiene rubbers with an average acrylic acid nitrile content and rubbers based on them were studied in the paper.Methods. The free surface energy of the samples was determined under the standard conditions and in the accelerated aging conditions with the use of the Owens, Wendt, Rabel, and Kaelble method.Results. It was shown that the elastomeric materials surface energy is influenced by surfactants such as rosin and stearic acid, which are typical ingredients of rubber compounds. It was also found that the thermal aging effect on the physical and mechanical properties of rubbers based on nitrile butadiene rubbers depends on the method of rubber isolation from latex and on the nature of the surfactant components in the samples.Conclusions. The analysis of the results obtained shows that the change in the vulcanizates physical and mechanical properties, depending on the technological additive content and the temperature effect, occurs along with a change in the critical surface tension.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"91044562","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-05-31DOI: 10.32362/2410-6593-2022-17-2-140-151
E. Pashkov, M. O. Korotysheva, A. V. Pak, E. Faizuloev, A. Sidorov, A. Poddubikov, E. Bystritskaya, Y. Dronina, V. K. Solntseva, T. A. Zaiceva, E. P. Pashkov, A. Bykov, O. Svitich, V. Zverev
Objectives. Evaluation of changes in the viral activity of influenza A/WSN/33 after complex knockdown of combinations of cellular genes FLT4, Nup98 and Nup205 in human lung cell culture A549. Methods. The work was carried out using the equipment of the Center for Collective Use of the I. Mechnikov Research Institute of Vaccines and Sera, Russia. The authors performed transfection of combinations of small interfering ribonucleic acid (siRNA) complexes that cause simultaneous disruption of the expression of cellular genes FLT4, Nup98, and Nup205. Within three days from the moment of transfection and infection, the supernatant fluid and cell lysate were taken for subsequent viral reproduction intensity determination using the titration method for cytopathic action. The dynamics of changes in the concentration of viral ribonucleic acid (vRNA) was determined by real-time reverse transcription polymerase chain reaction (real-time RT-PCR). The nonparametric Mann–Whitney test was used to calculate statistically significant differences between groups.Results. Using all of the combinations of siRNA complexes, cell viability did not decrease below the threshold level of 70%. In cells treated with complex FLT4.2 + Nup98.1 + Nup205 at the multiplicity of infection (MOI) equal to 0.1, a significant decrease in viral reproduction by 1.5 lg was noted on the first day in relation to nonspecific and viral controls. The use of siRNA complexes at MOI 0.01 resulted in a more pronounced antiviral effect. The viral titer in cells treated with siRNA complexes FLT4.2 + Nup98.1 and Nup98.1 + Nup205 decreased by 1.5 lg on the first day. In cells treated with complexes FLT4.2 + Nup205 and FLT4.2 + Nup98.1 + Nup205, it decreased by 1.8 and 2.0 lg on the first day and by 1.8 and 2.5 lg on the second day, respectively, in relation to nonspecific and viral controls. When conducting real-time RT-PCR, a significant decrease in the concentration of vRNA was noted. At MOI 0.1, a 295, 55, and 63-fold decrease in the viral load was observed with the use of siRNA complexes FLT4.2 + Nup98.1, Nup98.1 + Nup205, and FLT4.2 + Nup98.1 + Nup205, respectively. On the second day, a decrease in vRNA was also observed in cells treated with complex A. A 415-fold decrease in vRNA on the third day was noted in cells treated with complex FLT4.2 + Nup205. At MOI 0.01, the concentration of vRNA decreased 9.5 times when using complex B relative to nonspecific and viral control.Conclusions. The study showed a pronounced antiviral effect of siRNA combinations while simultaneously suppressing the activity of cellular genes (FLT4, Nup98, and Nup205), whose expression products are playing important role in the viral reproduction process, and obtained original designs of siRNA complexes. The results obtained are of great importance for the creation of emergence prophylactic and therapeutic drugs, whose action is based on the mechanism of RNA interference.
{"title":"Investigation of the anti-influenza activity of siRNA complexes against the cellular genes FLT4, Nup98, and Nup205 in vitro","authors":"E. Pashkov, M. O. Korotysheva, A. V. Pak, E. Faizuloev, A. Sidorov, A. Poddubikov, E. Bystritskaya, Y. Dronina, V. K. Solntseva, T. A. Zaiceva, E. P. Pashkov, A. Bykov, O. Svitich, V. Zverev","doi":"10.32362/2410-6593-2022-17-2-140-151","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-2-140-151","url":null,"abstract":"Objectives. Evaluation of changes in the viral activity of influenza A/WSN/33 after complex knockdown of combinations of cellular genes FLT4, Nup98 and Nup205 in human lung cell culture A549. Methods. The work was carried out using the equipment of the Center for Collective Use of the I. Mechnikov Research Institute of Vaccines and Sera, Russia. The authors performed transfection of combinations of small interfering ribonucleic acid (siRNA) complexes that cause simultaneous disruption of the expression of cellular genes FLT4, Nup98, and Nup205. Within three days from the moment of transfection and infection, the supernatant fluid and cell lysate were taken for subsequent viral reproduction intensity determination using the titration method for cytopathic action. The dynamics of changes in the concentration of viral ribonucleic acid (vRNA) was determined by real-time reverse transcription polymerase chain reaction (real-time RT-PCR). The nonparametric Mann–Whitney test was used to calculate statistically significant differences between groups.Results. Using all of the combinations of siRNA complexes, cell viability did not decrease below the threshold level of 70%. In cells treated with complex FLT4.2 + Nup98.1 + Nup205 at the multiplicity of infection (MOI) equal to 0.1, a significant decrease in viral reproduction by 1.5 lg was noted on the first day in relation to nonspecific and viral controls. The use of siRNA complexes at MOI 0.01 resulted in a more pronounced antiviral effect. The viral titer in cells treated with siRNA complexes FLT4.2 + Nup98.1 and Nup98.1 + Nup205 decreased by 1.5 lg on the first day. In cells treated with complexes FLT4.2 + Nup205 and FLT4.2 + Nup98.1 + Nup205, it decreased by 1.8 and 2.0 lg on the first day and by 1.8 and 2.5 lg on the second day, respectively, in relation to nonspecific and viral controls. When conducting real-time RT-PCR, a significant decrease in the concentration of vRNA was noted. At MOI 0.1, a 295, 55, and 63-fold decrease in the viral load was observed with the use of siRNA complexes FLT4.2 + Nup98.1, Nup98.1 + Nup205, and FLT4.2 + Nup98.1 + Nup205, respectively. On the second day, a decrease in vRNA was also observed in cells treated with complex A. A 415-fold decrease in vRNA on the third day was noted in cells treated with complex FLT4.2 + Nup205. At MOI 0.01, the concentration of vRNA decreased 9.5 times when using complex B relative to nonspecific and viral control.Conclusions. The study showed a pronounced antiviral effect of siRNA combinations while simultaneously suppressing the activity of cellular genes (FLT4, Nup98, and Nup205), whose expression products are playing important role in the viral reproduction process, and obtained original designs of siRNA complexes. The results obtained are of great importance for the creation of emergence prophylactic and therapeutic drugs, whose action is based on the mechanism of RNA interference.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-05-31","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"84752568","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-05-31DOI: 10.32362/2410-6593-2022-17-2-107-130
A. Polivanova, I. Solovieva, D. O. Botev, D. Y. Yuriev, A. Mylnikova, M. Oshchepkov
Objectives. The chemistry of 67Ga and 68Ga radionuclides plays a key role in nuclear medicine for applications in radiopharmaceuticals, in particular, in noninvasive in vivo molecular imaging techniques. The use of radiometals for labeling biomolecules typically requires the use of bifunctional chelators, which contain a functional group for covalent bonding with the targeting vector in addition to the polydentate fragment coordinating the metal. The aim of the present review article is to analyze the currently accumulated experimental material on the development and application of bifunctional chelators of gallium cations in medical research, as well as to identify the main requirements for the structure of the chelator and its complexes with 68Ga, which are used to create effective Gabased pharmaceutical preparations.Results. The review analyzed macrocyclic bifunctional chelators forming stable in vivo complexes with 68Ga and acyclic chelators, whose main advantage is faster complexation kinetics due to the short half-life of 68Ga. The advantages and disadvantages of both types of ligands were evaluated. In addition, a critical analysis of the binding constants and the conditions for the formation of complexes was presented. Examples of the influence of the geometry, lipophilicity, and total charge of the metal complex on the biodistribution of target radiopharmaceuticals were also given.Conclusions. Despite the progress made in the considered areas of bifunctional chelators, the problem of correlating the chemical structure of a metal-based radiopharmaceutical with its behavior in vivo remains important. Comparative studies of drugs having an identical targeting vector but containing different bifunctional chelating agents could help further elucidate the effectof metal chelate moiety on pharmacokinetics. In order to create effective bifunctional chelating agents, it is necessary to take into account such factors as the stability and inertness of the chelator and its complexes under physiological conditions, lipophilicity, complexation kinetics, chelation selectivity, combinatoriality of the basic structure, along with economic aspects, e.g., the availability of raw materials and the complexity of the synthesis scheme.
{"title":"Bifunctional gallium cation chelators","authors":"A. Polivanova, I. Solovieva, D. O. Botev, D. Y. Yuriev, A. Mylnikova, M. Oshchepkov","doi":"10.32362/2410-6593-2022-17-2-107-130","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-2-107-130","url":null,"abstract":"Objectives. The chemistry of 67Ga and 68Ga radionuclides plays a key role in nuclear medicine for applications in radiopharmaceuticals, in particular, in noninvasive in vivo molecular imaging techniques. The use of radiometals for labeling biomolecules typically requires the use of bifunctional chelators, which contain a functional group for covalent bonding with the targeting vector in addition to the polydentate fragment coordinating the metal. The aim of the present review article is to analyze the currently accumulated experimental material on the development and application of bifunctional chelators of gallium cations in medical research, as well as to identify the main requirements for the structure of the chelator and its complexes with 68Ga, which are used to create effective Gabased pharmaceutical preparations.Results. The review analyzed macrocyclic bifunctional chelators forming stable in vivo complexes with 68Ga and acyclic chelators, whose main advantage is faster complexation kinetics due to the short half-life of 68Ga. The advantages and disadvantages of both types of ligands were evaluated. In addition, a critical analysis of the binding constants and the conditions for the formation of complexes was presented. Examples of the influence of the geometry, lipophilicity, and total charge of the metal complex on the biodistribution of target radiopharmaceuticals were also given.Conclusions. Despite the progress made in the considered areas of bifunctional chelators, the problem of correlating the chemical structure of a metal-based radiopharmaceutical with its behavior in vivo remains important. Comparative studies of drugs having an identical targeting vector but containing different bifunctional chelating agents could help further elucidate the effectof metal chelate moiety on pharmacokinetics. In order to create effective bifunctional chelating agents, it is necessary to take into account such factors as the stability and inertness of the chelator and its complexes under physiological conditions, lipophilicity, complexation kinetics, chelation selectivity, combinatoriality of the basic structure, along with economic aspects, e.g., the availability of raw materials and the complexity of the synthesis scheme.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-05-31","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"77750474","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-05-31DOI: 10.32362/2410-6593-2022-17-2-131-139
A. Ha, Ch. T. P. Nguyen, T. Le
Objectives. The study aimed to test the ethanol extracts of ten medicinal plants for xanthine oxidase inhibitory activity.Methods. The degree of xanthine oxidase inhibitory activity was determined by measuring the absorbance spectrophotometrically at 290 nm, which is associated with uric acid formation. The selected medicinal plants included Piper lolot C.DC. (Piperaceae), Pandanus amaryllifolius R.(Pandanaceae), Brassica juncea L. (Brassicaceae), Piper betle L. (Piperaceae), Perilla frutescens L. (Lamiaceae), Anacardium occidentale L. (Anacardiaceae), Polygonum barbatum L. (Polygonaceae), Artocarpus Altilis P. (Moraceae), Vitex negundo L. (Verbenaceae), Annona squamosal L. (Annonaceae), which were selected based on folk medicine.Results. The results showed that the Piper betle L. has a strong ability to inhibit xanthine oxidase with an IC50 value of up to 1.18 μg/mL, compared to allopurinol 1.57 μg/mL. Different parts of Piper betle L. were compared and the leaves of Piper betle L. showed the best value for xanthine oxidase inhibitory and antioxidant activity.Conclusions. Piper betle L. showed the best potential for inhibition of xanthine oxidase among ten medicinal plants. Piper betle L. leaf extract showed strong xanthine oxidase inhibitory and antioxidant activity, compared to the whole plant, and the stem extract, which promises to be applied in the treatment of gout.
{"title":"Screening medicinal plant extracts for xanthine oxidase inhibitory activity","authors":"A. Ha, Ch. T. P. Nguyen, T. Le","doi":"10.32362/2410-6593-2022-17-2-131-139","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-2-131-139","url":null,"abstract":"Objectives. The study aimed to test the ethanol extracts of ten medicinal plants for xanthine oxidase inhibitory activity.Methods. The degree of xanthine oxidase inhibitory activity was determined by measuring the absorbance spectrophotometrically at 290 nm, which is associated with uric acid formation. The selected medicinal plants included Piper lolot C.DC. (Piperaceae), Pandanus amaryllifolius R.(Pandanaceae), Brassica juncea L. (Brassicaceae), Piper betle L. (Piperaceae), Perilla frutescens L. (Lamiaceae), Anacardium occidentale L. (Anacardiaceae), Polygonum barbatum L. (Polygonaceae), Artocarpus Altilis P. (Moraceae), Vitex negundo L. (Verbenaceae), Annona squamosal L. (Annonaceae), which were selected based on folk medicine.Results. The results showed that the Piper betle L. has a strong ability to inhibit xanthine oxidase with an IC50 value of up to 1.18 μg/mL, compared to allopurinol 1.57 μg/mL. Different parts of Piper betle L. were compared and the leaves of Piper betle L. showed the best value for xanthine oxidase inhibitory and antioxidant activity.Conclusions. Piper betle L. showed the best potential for inhibition of xanthine oxidase among ten medicinal plants. Piper betle L. leaf extract showed strong xanthine oxidase inhibitory and antioxidant activity, compared to the whole plant, and the stem extract, which promises to be applied in the treatment of gout.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-05-31","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"82047824","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-05-31DOI: 10.32362/2410-6593-2022-17-2-87-106
A. Frolkova, A. V. Frolkova, V. Raeva, V. Zhuchkov
Objectives. To improve the process of developing energy-efficient flowsheets for the distillation separation of multicomponent aqueous and organic mixtures based on a comprehensive study of the phase diagram structures, including those in the presence of additional selective substances.Methods. Thermodynamic-topological analysis of phase diagrams; modeling of phase equilibria in the AspenTech software package using the equations of local compositions: Non-Random Two Liquid and Wilson; computational experiment to determine the column parameters for separation flowsheets of model and real mixtures of various nature.Results. The fractionation conditions of the origin multicomponent mixture due to the use of sharp distillation, pre-splitting process, extractive distillation with individual and binary separating agents were revealed. The columns operation parameters and the energy consumption of the separation flowsheets ensuring the achievement of the required product quality with minimal energy consumption were determined.Conclusions. Using the original methods developed by the authors earlier and based on the generalization of the results obtained, new approaches to the synthesis of energy-efficient multicomponent mixtures separation flowsheets were proposed. The provisions that form the methodological basis for the development of flowsheets for the separation of multicomponent mixtures and supplement the standard flowsheet synthesis plan with new procedures were formulated.
目标。通过对多组分水、有机混合物的相图结构(包括存在额外选择性物质时的相图结构)的全面研究，改进开发高效能蒸馏分离流程的过程。相图的热力学拓扑分析;在AspenTech软件包中使用局部组成方程建模相平衡:Non-Random Two Liquid和Wilson;计算实验确定不同性质的模型和实际混合物分离流程的柱参数。揭示了采用尖锐精馏、预分裂、萃取精馏、单分离剂和二元分离剂对原多组分混合物进行分馏的条件。确定了色谱柱的操作参数和各分离流程的能耗，以保证以最小的能耗达到要求的产品质量。在此基础上，提出了合成高效节能多组分混合物分离流程的新方法。制定了构成多组分混合物分离流程图开发的方法学基础的规定，并用新程序补充了标准流程图合成计划。
{"title":"Features of distillation separation of multicomponent mixtures","authors":"A. Frolkova, A. V. Frolkova, V. Raeva, V. Zhuchkov","doi":"10.32362/2410-6593-2022-17-2-87-106","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-2-87-106","url":null,"abstract":"Objectives. To improve the process of developing energy-efficient flowsheets for the distillation separation of multicomponent aqueous and organic mixtures based on a comprehensive study of the phase diagram structures, including those in the presence of additional selective substances.Methods. Thermodynamic-topological analysis of phase diagrams; modeling of phase equilibria in the AspenTech software package using the equations of local compositions: Non-Random Two Liquid and Wilson; computational experiment to determine the column parameters for separation flowsheets of model and real mixtures of various nature.Results. The fractionation conditions of the origin multicomponent mixture due to the use of sharp distillation, pre-splitting process, extractive distillation with individual and binary separating agents were revealed. The columns operation parameters and the energy consumption of the separation flowsheets ensuring the achievement of the required product quality with minimal energy consumption were determined.Conclusions. Using the original methods developed by the authors earlier and based on the generalization of the results obtained, new approaches to the synthesis of energy-efficient multicomponent mixtures separation flowsheets were proposed. The provisions that form the methodological basis for the development of flowsheets for the separation of multicomponent mixtures and supplement the standard flowsheet synthesis plan with new procedures were formulated.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-05-31","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"85179567","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-04-09DOI: 10.32362/2410-6593-2022-17-1-30-38
A. Nikolaev, B. V. Peshnev, E. V. Egorova
Objectives. A characteristic feature of oil production is an increase in the volume of highviscosity bituminous oil. In Russia, technologies based on the use of water vapor are used for their extraction. The use of such technologies leads to a large amount of water in the product stream from the production well. Preparation of oil for processing involves its stabilization, desalination, and dewatering. Since the densities of the extracted oil and the water contained in it are comparable, traditional preparation schemes for processing of high-viscosity bituminous oil are ineffective. One of the possible solutions to the problem involving such oil in the fuel, energy, and petrochemical balance is to use a coking process at the first stage of its processing. This aim can be achieved by studying the influence of the process conditions of coking high-viscosity water-containing oil on the yield and characteristics of the resulting products.Methods. Coking of oil with a density of 1.0200 g/cm3 at 50 °C and with 18 wt % water content was carried out in a laboratory installation in a “cube.” A hollow cylindrical apparatus was used as a reactor and was placed in a furnace. The temperature and pressure in the reactor were maintained at 500–700 °C and 0.10–0.35 MPa, respectively.Results. An increase in the coking process temperature results in an increase in the amount of gaseous products, a decrease in the amount of the coke generated, and a higher dependence of the amount of liquid products on temperature with a maximum yield at 550–600 °C. The process temperature also affects the composition of liquid products. At a lower temperature, the amount of gasoline and kerosene fractions in liquid products is higher. With an increase in pressure, a higher amount of gaseous products, coke, and low-molecular-weight hydrocarbon fractions in liquid products could also be obtained. The characteristics of the coke produced in the coking process are similar to those of commercially produced grades. It is noted that when coking water-containing oil, up to 98% of the emulsion water goes with liquid products, and the remaining amount of water remains in the formed coke.Conclusions. Results showed the possible application of the coking process at the initial stage of processing high-viscosity bituminous oil. In this case, the dewatering stage is significantly simplified since the technological scheme of delayed coking allows the separation of the gasoline fraction from water.
{"title":"Coking of high-viscosity water-containing oil","authors":"A. Nikolaev, B. V. Peshnev, E. V. Egorova","doi":"10.32362/2410-6593-2022-17-1-30-38","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-1-30-38","url":null,"abstract":"Objectives. A characteristic feature of oil production is an increase in the volume of highviscosity bituminous oil. In Russia, technologies based on the use of water vapor are used for their extraction. The use of such technologies leads to a large amount of water in the product stream from the production well. Preparation of oil for processing involves its stabilization, desalination, and dewatering. Since the densities of the extracted oil and the water contained in it are comparable, traditional preparation schemes for processing of high-viscosity bituminous oil are ineffective. One of the possible solutions to the problem involving such oil in the fuel, energy, and petrochemical balance is to use a coking process at the first stage of its processing. This aim can be achieved by studying the influence of the process conditions of coking high-viscosity water-containing oil on the yield and characteristics of the resulting products.Methods. Coking of oil with a density of 1.0200 g/cm3 at 50 °C and with 18 wt % water content was carried out in a laboratory installation in a “cube.” A hollow cylindrical apparatus was used as a reactor and was placed in a furnace. The temperature and pressure in the reactor were maintained at 500–700 °C and 0.10–0.35 MPa, respectively.Results. An increase in the coking process temperature results in an increase in the amount of gaseous products, a decrease in the amount of the coke generated, and a higher dependence of the amount of liquid products on temperature with a maximum yield at 550–600 °C. The process temperature also affects the composition of liquid products. At a lower temperature, the amount of gasoline and kerosene fractions in liquid products is higher. With an increase in pressure, a higher amount of gaseous products, coke, and low-molecular-weight hydrocarbon fractions in liquid products could also be obtained. The characteristics of the coke produced in the coking process are similar to those of commercially produced grades. It is noted that when coking water-containing oil, up to 98% of the emulsion water goes with liquid products, and the remaining amount of water remains in the formed coke.Conclusions. Results showed the possible application of the coking process at the initial stage of processing high-viscosity bituminous oil. In this case, the dewatering stage is significantly simplified since the technological scheme of delayed coking allows the separation of the gasoline fraction from water. ","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-04-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"76935437","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-04-09DOI: 10.32362/2410-6593-2022-17-1-65-75
A. Markov, V. Lobanov
Objectives. The study assessed the possibility of using optical-polarization methods to test quantitatively the stress state and residual stress in polycarbonate (PC) monolithic sheets. This stress is the leading cause of the cracking of PC sheets and the products made of them.Methods. The objects were samples of monolithic PC sheets made by various manufacturers (Monogal and Novattro). The birefringence method was used to study the stress state of the samples, and the interference images obtained in polarized light in crossed polaroids were analyzed.Results. The efficiency of optical-polarization research methods, such as the birefringence and the analysis of the interference images of stretched PC samples combined into an additive spectrum, was shown. The residual stress in the monolithic PC sheets made by various manufacturers was estimated.Conclusions. The quantitative relationship between the stress acting on the PC samples, their birefringence, and the characteristics of their additive spectrum of interference images of stressed samples obtained in polarized light in crossed polaroids was established. The possibility of a quantitative assessment of the residual stress in monolithic PC sheets based on an analysis of their additive spectrum of interference images was shown. The measured residual stress did not exceed 1 MPa.
{"title":"Study of the stress state of polycarbonate monolithic sheets using optical-polarization methods","authors":"A. Markov, V. Lobanov","doi":"10.32362/2410-6593-2022-17-1-65-75","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-1-65-75","url":null,"abstract":"Objectives. The study assessed the possibility of using optical-polarization methods to test quantitatively the stress state and residual stress in polycarbonate (PC) monolithic sheets. This stress is the leading cause of the cracking of PC sheets and the products made of them.Methods. The objects were samples of monolithic PC sheets made by various manufacturers (Monogal and Novattro). The birefringence method was used to study the stress state of the samples, and the interference images obtained in polarized light in crossed polaroids were analyzed.Results. The efficiency of optical-polarization research methods, such as the birefringence and the analysis of the interference images of stretched PC samples combined into an additive spectrum, was shown. The residual stress in the monolithic PC sheets made by various manufacturers was estimated.Conclusions. The quantitative relationship between the stress acting on the PC samples, their birefringence, and the characteristics of their additive spectrum of interference images of stressed samples obtained in polarized light in crossed polaroids was established. The possibility of a quantitative assessment of the residual stress in monolithic PC sheets based on an analysis of their additive spectrum of interference images was shown. The measured residual stress did not exceed 1 MPa.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-04-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"85522313","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-04-09DOI: 10.32362/2410-6593-2022-17-1-7-17
V. V. Emelyanov, E. L. Krasnykh, D. Fetisov, S. V. Levanova, V. A. Shakun
Objectives. Due to their structures, pentaerythritol esters have a number of appealing properties such as high viscosity index when used as oils and excellent compatibility with polyvinyl chloride when used as plasticizers. For the production of pentaerythritol and carboxylic acids, natural gas can be used as a feedstock, which implies a strategic development of the petrochemical industry, a decrease in the amount of gas used for combustion, and its applications for the production of chemical products.Methods. The synthesis process was conducted in a self-catalysis mode with excess acids in a molar ratio of 8:1 and in the presence of a solvent (toluene) of ~30% per reaction mass. This ensures a uniform distillation of the reaction water at a constant temperature of 100–110 °C, a decrease in the side reaction products, and an increase in process selectivity. The products from the reaction mass were isolated by vacuum distillation, and identification of all the synthesized tetraesters was performed by chromatography–mass spectrometry analysis.Results. This work proposes options for optimizing the conditions of the thermal esterification of pentaerythritol with isomeric monocarboxylic acids (isobutyric, isovaleric, pivalic, and 2-ethylhexanoic acids) that have different reactivities due to their structures. Methods for isolating tetraesters of pentaerythritol and corresponding acids have been developed. The characteristics of the main series of ions of tetraesters of pentaerythritol and aliphatic isomeric acids C4–C8 in the mass spectra were obtained.Conclusions. The yields of tetraesters were at 95%–96% of the theoretical value, and product purity was >99.6%. The resulting target products (tetraesters) were characterized by relative color stability, where the maximum degree of color after cleaning was less than 20 units according to Hazen (180 units for tetra-2-ethylhexnoate), which corresponds to the standards in GOST 29131-91 (ISO 2211-73). The esterification rates were compared, and it was shown that the quantitative yields of isomeric tetraesters at 100–110 °C were achieved in 12–15 h for isobutyric and isovaleric acids, 25–27 h for 2-ethyl-hexanoic acid, and ~40 h for pivalic acid.
{"title":"Features of the synthesis of pentaerythritol esters and carboxylic acids of aliphatic isomeric structure","authors":"V. V. Emelyanov, E. L. Krasnykh, D. Fetisov, S. V. Levanova, V. A. Shakun","doi":"10.32362/2410-6593-2022-17-1-7-17","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-1-7-17","url":null,"abstract":"Objectives. Due to their structures, pentaerythritol esters have a number of appealing properties such as high viscosity index when used as oils and excellent compatibility with polyvinyl chloride when used as plasticizers. For the production of pentaerythritol and carboxylic acids, natural gas can be used as a feedstock, which implies a strategic development of the petrochemical industry, a decrease in the amount of gas used for combustion, and its applications for the production of chemical products.Methods. The synthesis process was conducted in a self-catalysis mode with excess acids in a molar ratio of 8:1 and in the presence of a solvent (toluene) of ~30% per reaction mass. This ensures a uniform distillation of the reaction water at a constant temperature of 100–110 °C, a decrease in the side reaction products, and an increase in process selectivity. The products from the reaction mass were isolated by vacuum distillation, and identification of all the synthesized tetraesters was performed by chromatography–mass spectrometry analysis.Results. This work proposes options for optimizing the conditions of the thermal esterification of pentaerythritol with isomeric monocarboxylic acids (isobutyric, isovaleric, pivalic, and 2-ethylhexanoic acids) that have different reactivities due to their structures. Methods for isolating tetraesters of pentaerythritol and corresponding acids have been developed. The characteristics of the main series of ions of tetraesters of pentaerythritol and aliphatic isomeric acids C4–C8 in the mass spectra were obtained.Conclusions. The yields of tetraesters were at 95%–96% of the theoretical value, and product purity was >99.6%. The resulting target products (tetraesters) were characterized by relative color stability, where the maximum degree of color after cleaning was less than 20 units according to Hazen (180 units for tetra-2-ethylhexnoate), which corresponds to the standards in GOST 29131-91 (ISO 2211-73). The esterification rates were compared, and it was shown that the quantitative yields of isomeric tetraesters at 100–110 °C were achieved in 12–15 h for isobutyric and isovaleric acids, 25–27 h for 2-ethyl-hexanoic acid, and ~40 h for pivalic acid. ","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-04-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"86763235","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2022-04-09DOI: 10.32362/2410-6593-2022-17-1-50-64
M. D. Korotkin, S. M. Filatova, Z. Denieva, U. A. Budanova, Y. Sebyakin
Objectives. Resistance to antibiotics and other antimicrobial drugs is an acute problem in the world today. Therefore, the chemical and pharmaceutical industries are still in search of new antibacterial agents that can overcome the resistance of pathogenic bacterial strains. To date, it has been established that molecules with antimicrobial activity must have an amphiphilic nature, a small size, one or more positive charges, and the required degree of hydrophobicity, that is, a significant hydrophilic–lipophilic balance (HLB) value. Some examples of such structures are antimicrobial peptides or peptidomimetics. This study aimed to develop a universal scheme for synthesizing several amino acid derivatives based on diethanolamine diesters with symmetric and asymmetric radicals in a hydrophobic block and potential antibacterial activity.Methods. The progression of chemical reactions was analyzed using thin-layer chromatography (TLC) on Sorbfil plates. The obtained compounds were isolated and purified using preparative TLC on Kieselgel (Merck) 60 F254 plates and column chromatography on Merck silica gel 0.040–0.063 mm. The TLC method was used to detect substances using a 3% ninhydrin solution, followed by heating to 70 °C. The structures of the obtained compounds were confirmed by hydrogen-1 nuclear magnetic resonance (1H NMR) spectroscopy on a Bruker WM-300 pulse NMR spectrometer, with hexamethyldisiloxane serving as the internal standard.Results. The HLB values of the diethanolamine derivatives were calculated, and samples were selected for subsequent synthesis. A scheme was developed for preparing amino acid derivatives based on diethanolamine diesters with symmetric and asymmetric radicals in the hydrophobic domain, and five new compounds were synthesized. The hydrophilic blocks of these compounds included residues of amino acids such as glycine, β-alanine, L-ornithine, and L-lysine.Conclusions. The potential antimicrobial activity of the synthesized peptidomimetics was assessed by their HLB values using the ACD/Labs Log P program. New amphiphiles were synthesized using amino acids and diethanolamine, and their structures were confirmed by 1H NMR spectroscopy data. The synthesized compounds were prepared for antibacterial activity analysis.
{"title":"Synthesis of diethanolamine-based amino acid derivatives with symmetric and asymmetric radicals in their hydrophobic domain and potential antimicrobial activity","authors":"M. D. Korotkin, S. M. Filatova, Z. Denieva, U. A. Budanova, Y. Sebyakin","doi":"10.32362/2410-6593-2022-17-1-50-64","DOIUrl":"https://doi.org/10.32362/2410-6593-2022-17-1-50-64","url":null,"abstract":"Objectives. Resistance to antibiotics and other antimicrobial drugs is an acute problem in the world today. Therefore, the chemical and pharmaceutical industries are still in search of new antibacterial agents that can overcome the resistance of pathogenic bacterial strains. To date, it has been established that molecules with antimicrobial activity must have an amphiphilic nature, a small size, one or more positive charges, and the required degree of hydrophobicity, that is, a significant hydrophilic–lipophilic balance (HLB) value. Some examples of such structures are antimicrobial peptides or peptidomimetics. This study aimed to develop a universal scheme for synthesizing several amino acid derivatives based on diethanolamine diesters with symmetric and asymmetric radicals in a hydrophobic block and potential antibacterial activity.Methods. The progression of chemical reactions was analyzed using thin-layer chromatography (TLC) on Sorbfil plates. The obtained compounds were isolated and purified using preparative TLC on Kieselgel (Merck) 60 F254 plates and column chromatography on Merck silica gel 0.040–0.063 mm. The TLC method was used to detect substances using a 3% ninhydrin solution, followed by heating to 70 °C. The structures of the obtained compounds were confirmed by hydrogen-1 nuclear magnetic resonance (1H NMR) spectroscopy on a Bruker WM-300 pulse NMR spectrometer, with hexamethyldisiloxane serving as the internal standard.Results. The HLB values of the diethanolamine derivatives were calculated, and samples were selected for subsequent synthesis. A scheme was developed for preparing amino acid derivatives based on diethanolamine diesters with symmetric and asymmetric radicals in the hydrophobic domain, and five new compounds were synthesized. The hydrophilic blocks of these compounds included residues of amino acids such as glycine, β-alanine, L-ornithine, and L-lysine.Conclusions. The potential antimicrobial activity of the synthesized peptidomimetics was assessed by their HLB values using the ACD/Labs Log P program. New amphiphiles were synthesized using amino acids and diethanolamine, and their structures were confirmed by 1H NMR spectroscopy data. The synthesized compounds were prepared for antibacterial activity analysis.","PeriodicalId":12215,"journal":{"name":"Fine Chemical Technologies","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2022-04-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"87727265","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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