首页 > 最新文献

Chemistry最新文献

英文 中文
Recent Advances in C–H Functionalization of Pyrenes 芘的 C-H 功能化最新进展
Q3 Chemistry Pub Date : 2023-12-11 DOI: 10.3390/chemistry5040175
Srinivasarao Arulananda Babu, Arup Dalal, Subhankar Bodak
In recent years, transition metal-catalyzed C–H activation and site-selective functionalization have been considered to be valuable synthetic tactics to functionalize organic compounds containing multiple C–H bonds. Pyrene is one of the privileged and notorious polycyclic aromatic hydrocarbons. Pyrene and its derivatives have found applications in various branches of chemical sciences, including organic chemistry, chemical biology, supramolecular sciences, and material sciences. Given the importance of pyrene derivatives, several classical methods, including the C–H functionalization method, have been developed for synthesizing modified pyrene scaffolds. This review attempts to cover the recent developments in the area pertaining to the modification of the pyrene motif through the C–H activation process and the functionalization of C–H bonds present in the pyrene motif, leading to functionalized pyrenes.
近年来,过渡金属催化的 C-H 活化和位点选择性官能化被认为是对含有多个 C-H 键的有机化合物进行官能化的重要合成策略。芘是著名的多环芳烃之一。芘及其衍生物已被应用于化学科学的各个分支,包括有机化学、化学生物学、超分子科学和材料科学。鉴于芘衍生物的重要性,包括 C-H 功能化法在内的几种经典方法已被用于合成改性芘支架。本综述试图介绍通过 C-H 活化过程对芘基团进行修饰,以及对芘基团中的 C-H 键进行官能化,从而制备出官能化芘的最新进展。
{"title":"Recent Advances in C–H Functionalization of Pyrenes","authors":"Srinivasarao Arulananda Babu, Arup Dalal, Subhankar Bodak","doi":"10.3390/chemistry5040175","DOIUrl":"https://doi.org/10.3390/chemistry5040175","url":null,"abstract":"In recent years, transition metal-catalyzed C–H activation and site-selective functionalization have been considered to be valuable synthetic tactics to functionalize organic compounds containing multiple C–H bonds. Pyrene is one of the privileged and notorious polycyclic aromatic hydrocarbons. Pyrene and its derivatives have found applications in various branches of chemical sciences, including organic chemistry, chemical biology, supramolecular sciences, and material sciences. Given the importance of pyrene derivatives, several classical methods, including the C–H functionalization method, have been developed for synthesizing modified pyrene scaffolds. This review attempts to cover the recent developments in the area pertaining to the modification of the pyrene motif through the C–H activation process and the functionalization of C–H bonds present in the pyrene motif, leading to functionalized pyrenes.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"11 21","pages":""},"PeriodicalIF":0.0,"publicationDate":"2023-12-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138980992","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}
引用次数: 0
Iron-Promoted 1,5-Substitution Reaction of Endocyclic Enyne Oxiranes with MeMgBr: A Stereoselective Method for the Synthesis of Exocyclic 2,4,5-Trienol Derivatives 铁促进内环炔肟与 MeMgBr 的 1,5 取代反应:合成外环 2,4,5-三烯酚衍生物的立体选择性方法
Q3 Chemistry Pub Date : 2023-12-01 DOI: 10.3390/chemistry5040173
Melih Kuş, Cenk Omur, Sıla Karaca, Levent Artok
The iron-promoted 1,5-substitution reaction of endocyclic oxiranes with MeMgBr yields exocyclic 2,4,5-trienols with high diastereomeric ratios of up to 100:0. However, for the method’s success, the oxirane ring must have a trans-configuration. The reactions exhibit strong stereoselectivity concerning the methylation mode and the configuration of the resulting exocyclic double bond. Enantiomerically pure enyne oxiranes can be synthesized through Sharpless asymmetric dihydroxylation and subsequent manipulations. With these reagents, it has been possible to produce exocyclic 2,4,5-trienols in enantiopure forms. Importantly, this process maintains chirality without degradation during the center-to-axis transfer of chirality.
铁促进的内环氧烷与MeMgBr的1,5取代反应产生高非对映比的外环2,4,5-三烯醇,其非对映比高达100:0。然而,为了使该方法成功,氧烷环必须具有反式构型。在甲基化模式和生成的外环双键构型方面,反应表现出很强的立体选择性。通过Sharpless不对称二羟基化和随后的操作可以合成对映体纯的环氧烷。有了这些试剂,就有可能产生对映不纯的2,4,5-三烯醇外环。重要的是,在手性中心到轴的转移过程中,该过程保持手性而不降低。
{"title":"Iron-Promoted 1,5-Substitution Reaction of Endocyclic Enyne Oxiranes with MeMgBr: A Stereoselective Method for the Synthesis of Exocyclic 2,4,5-Trienol Derivatives","authors":"Melih Kuş, Cenk Omur, Sıla Karaca, Levent Artok","doi":"10.3390/chemistry5040173","DOIUrl":"https://doi.org/10.3390/chemistry5040173","url":null,"abstract":"The iron-promoted 1,5-substitution reaction of endocyclic oxiranes with MeMgBr yields exocyclic 2,4,5-trienols with high diastereomeric ratios of up to 100:0. However, for the method’s success, the oxirane ring must have a trans-configuration. The reactions exhibit strong stereoselectivity concerning the methylation mode and the configuration of the resulting exocyclic double bond. Enantiomerically pure enyne oxiranes can be synthesized through Sharpless asymmetric dihydroxylation and subsequent manipulations. With these reagents, it has been possible to produce exocyclic 2,4,5-trienols in enantiopure forms. Importantly, this process maintains chirality without degradation during the center-to-axis transfer of chirality.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":" 42","pages":""},"PeriodicalIF":0.0,"publicationDate":"2023-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138616805","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}
引用次数: 0
Chiral Hydroxamic Acid Ligands in the Asymmetric Synthesis of Natural Products 天然产品不对称合成中的手性羟肟酸配体
Q3 Chemistry Pub Date : 2023-12-01 DOI: 10.3390/chemistry5040174
T. Pawar, Karla Irazu Ventura-Hernández, F. R. Ramos-Morales, J. L. Olivares-Romero
Chiral hydroxamic acid (HA) and bis-hydroxamic acid (BHA) ligands have made significant contributions to the field of asymmetric synthesis, particularly in the synthesis of natural products. These ligands possess unique molecular structures that allow for exceptional stereochemical control, leading to their widespread use in catalytic systems. This review highlights the advancements made in asymmetric synthesis using chiral hydroxamic acid and bis-hydroxamic acid ligands and their impact on the synthesis of complex natural products. This discussion encompasses their role in enantioselective C–C bond formation, the functionalization of C–H bonds, the asymmetric transformations involving heteroatoms, and their application in the total synthesis of natural products. The versatility and efficiency of chiral hydroxamic acid ligands and bis-hydroxamic acid ligands make them invaluable tools for synthetic chemists working towards the efficient and selective synthesis of natural products. This review provides a comprehensive overview of their contributions, showcasing their potential to expand the boundaries of chemical synthesis and access the diverse array of natural product scaffolds.
手性羟肟酸(HA)和双羟肟酸(BHA)配体在不对称合成领域,特别是在天然产物的合成中做出了重要贡献。这些配体具有独特的分子结构,允许特殊的立体化学控制,导致它们在催化系统中的广泛应用。本文综述了手性羟肟酸和双羟肟酸配体在不对称合成方面的研究进展及其对复杂天然产物合成的影响。本文讨论了它们在对映选择性C-C键的形成、C-H键的功能化、涉及杂原子的不对称转化以及它们在天然产物全合成中的应用。手性羟肟酸配体和双羟肟酸配体的多功能性和效率使它们成为合成化学家致力于高效和选择性合成天然产物的宝贵工具。这篇综述提供了他们的贡献的全面概述,展示了他们的潜力,以扩大化学合成的边界和获取多样化的天然产物支架。
{"title":"Chiral Hydroxamic Acid Ligands in the Asymmetric Synthesis of Natural Products","authors":"T. Pawar, Karla Irazu Ventura-Hernández, F. R. Ramos-Morales, J. L. Olivares-Romero","doi":"10.3390/chemistry5040174","DOIUrl":"https://doi.org/10.3390/chemistry5040174","url":null,"abstract":"Chiral hydroxamic acid (HA) and bis-hydroxamic acid (BHA) ligands have made significant contributions to the field of asymmetric synthesis, particularly in the synthesis of natural products. These ligands possess unique molecular structures that allow for exceptional stereochemical control, leading to their widespread use in catalytic systems. This review highlights the advancements made in asymmetric synthesis using chiral hydroxamic acid and bis-hydroxamic acid ligands and their impact on the synthesis of complex natural products. This discussion encompasses their role in enantioselective C–C bond formation, the functionalization of C–H bonds, the asymmetric transformations involving heteroatoms, and their application in the total synthesis of natural products. The versatility and efficiency of chiral hydroxamic acid ligands and bis-hydroxamic acid ligands make them invaluable tools for synthetic chemists working towards the efficient and selective synthesis of natural products. This review provides a comprehensive overview of their contributions, showcasing their potential to expand the boundaries of chemical synthesis and access the diverse array of natural product scaffolds.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":" 7","pages":""},"PeriodicalIF":0.0,"publicationDate":"2023-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138613676","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}
引用次数: 0
Polymerization Behavior and Rheological Properties of a Surfactant-Modified Reactive Hydrophobic Monomer 表面活性剂改性反应性疏水单体的聚合行为和流变性能
Q3 Chemistry Pub Date : 2023-11-14 DOI: 10.3390/chemistry5040168
Xin Wen, Lei Wang, Xiaojuan Lai, Guiru Liu, Wenwen Yang, Jinhao Gao, Yameng Liu, Wenyu Cui
The structures and properties of hydrophobic association polymers can be controlled using micelles. In this work, we synthesize a reactive hydrophobic surfactant monomer, KS-3, from oleic acid, N,N-dimethylpropylenediamine, and allyl chloride. A strong synergistic effect between KS-3 and cocamidopropyl betaine in aqueous solution enhances the hydrophilic dispersibility of KS-3, thereby transforming spherical micelles into cylindrical micelles. KS-3 was grafted onto a polyacrylamide chain via aqueous free-radical polymerization to obtain RES, a hydrophobic association polymer. Structural analysis revealed that the RES polymers assembled in wormlike micelles were more tightly arranged than those assembled in spherical micelles, resulting in a compact network structure in water, smooth surface, and high thermal stability. Rheological tests revealed that the synthesized polymers with wormlike and spherical micelles exhibited shear-thinning properties along with different structural strengths and viscoelasticities. Therefore, controlling the micellar state can effectively regulate the polymer properties. The polymers obtained through wormlike micelle polymerization have potential applications in fields with high demands, such as drug release, water purification, and oilfield development.
疏水缔合聚合物的结构和性能可以用胶束来控制。本文以油酸、N,N-二甲基丙二胺和氯丙烯为原料,合成了一种反应性疏水表面活性剂单体KS-3。在水溶液中,KS-3与椰油酰胺丙基甜菜碱具有较强的协同作用,增强了KS-3的亲水性分散性,从而使球形胶束转变为圆柱形胶束。通过水自由基聚合将KS-3接枝到聚丙烯酰胺链上,得到疏水缔合聚合物RES。结构分析表明,以蠕虫状胶束组装的RES聚合物比以球形胶束组装的RES聚合物排列更紧密,在水中网状结构紧凑,表面光滑,热稳定性高。流变学试验表明,合成的蠕虫状和球形胶束聚合物具有剪切减薄特性,且具有不同的结构强度和粘弹性。因此,控制胶束状态可以有效地调节聚合物的性能。通过虫状胶束聚合获得的聚合物在药物释放、水净化、油田开发等高要求领域具有潜在的应用前景。
{"title":"Polymerization Behavior and Rheological Properties of a Surfactant-Modified Reactive Hydrophobic Monomer","authors":"Xin Wen, Lei Wang, Xiaojuan Lai, Guiru Liu, Wenwen Yang, Jinhao Gao, Yameng Liu, Wenyu Cui","doi":"10.3390/chemistry5040168","DOIUrl":"https://doi.org/10.3390/chemistry5040168","url":null,"abstract":"The structures and properties of hydrophobic association polymers can be controlled using micelles. In this work, we synthesize a reactive hydrophobic surfactant monomer, KS-3, from oleic acid, N,N-dimethylpropylenediamine, and allyl chloride. A strong synergistic effect between KS-3 and cocamidopropyl betaine in aqueous solution enhances the hydrophilic dispersibility of KS-3, thereby transforming spherical micelles into cylindrical micelles. KS-3 was grafted onto a polyacrylamide chain via aqueous free-radical polymerization to obtain RES, a hydrophobic association polymer. Structural analysis revealed that the RES polymers assembled in wormlike micelles were more tightly arranged than those assembled in spherical micelles, resulting in a compact network structure in water, smooth surface, and high thermal stability. Rheological tests revealed that the synthesized polymers with wormlike and spherical micelles exhibited shear-thinning properties along with different structural strengths and viscoelasticities. Therefore, controlling the micellar state can effectively regulate the polymer properties. The polymers obtained through wormlike micelle polymerization have potential applications in fields with high demands, such as drug release, water purification, and oilfield development.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"17 7","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"134900962","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}
引用次数: 0
Quantitative Determination of Fluoride Mass Concentration in Beers Produced in Croatia Using the Standard Addition Method in Potentiometry 用电位法标准加成法定量测定克罗地亚啤酒中氟化物质量浓度
Q3 Chemistry Pub Date : 2023-11-14 DOI: 10.3390/chemistry5040167
Maša Buljac, Marija Bralić, Nives Vladislavić, Josipa Dugeč, Josip Radić
It is well known that beer is more than 90% water, and therefore, water can be one of the main sources of fluoride in beers. With this in mind, the goal of the present study was to determine the mass concentration of fluoride in 53 beer samples. Using the recently published standard addition method in potentiometry, the fluoride content of 28 samples of the most consumed beers in the Republic of Croatia was determined. The remaining 25 beer samples tested came from so-called microbreweries, which together account for less than 10% of the Croatian market. Fluoride concentrations in light beers ranged from 49 to 180 μg L−1, with a mean value of 95 ± 34 μg L−1, and from 52 to 164 μg L−1, with a mean value of 89 ± 29 μg L−1 in dark beers. The mean value of fluoride content in beers from large producers was 100 ± 38 μg L−1 and 89 ± 38 μg L−1 in beers from small producers. All values are within the recommended range and thus do not pose a risk to human health. The statistical analysis showed no correlation between the mass concentration of fluoride and pH, i.e., alcohol content in beers.
众所周知,啤酒中90%以上是水,因此,水可能是啤酒中氟化物的主要来源之一。考虑到这一点,本研究的目的是确定53个啤酒样品中氟化物的质量浓度。使用最近公布的电位法标准加成法,对克罗地亚共和国消费量最大的28种啤酒样品的氟化物含量进行了测定。剩下的25种啤酒样本来自所谓的微型啤酒厂,它们加起来只占克罗地亚市场的不到10%。淡啤中的氟化物浓度为49 ~ 180 μg L−1,平均值为95±34 μg L−1;黑啤中的氟化物浓度为52 ~ 164 μg L−1,平均值为89±29 μg L−1。大型啤酒中氟含量平均值为100±38 μg L−1,小型啤酒中氟含量平均值为89±38 μg L−1。所有数值均在建议范围内,因此不会对人体健康构成风险。统计分析表明,氟化物的质量浓度与pH值(即啤酒中的酒精含量)之间没有相关性。
{"title":"Quantitative Determination of Fluoride Mass Concentration in Beers Produced in Croatia Using the Standard Addition Method in Potentiometry","authors":"Maša Buljac, Marija Bralić, Nives Vladislavić, Josipa Dugeč, Josip Radić","doi":"10.3390/chemistry5040167","DOIUrl":"https://doi.org/10.3390/chemistry5040167","url":null,"abstract":"It is well known that beer is more than 90% water, and therefore, water can be one of the main sources of fluoride in beers. With this in mind, the goal of the present study was to determine the mass concentration of fluoride in 53 beer samples. Using the recently published standard addition method in potentiometry, the fluoride content of 28 samples of the most consumed beers in the Republic of Croatia was determined. The remaining 25 beer samples tested came from so-called microbreweries, which together account for less than 10% of the Croatian market. Fluoride concentrations in light beers ranged from 49 to 180 μg L−1, with a mean value of 95 ± 34 μg L−1, and from 52 to 164 μg L−1, with a mean value of 89 ± 29 μg L−1 in dark beers. The mean value of fluoride content in beers from large producers was 100 ± 38 μg L−1 and 89 ± 38 μg L−1 in beers from small producers. All values are within the recommended range and thus do not pose a risk to human health. The statistical analysis showed no correlation between the mass concentration of fluoride and pH, i.e., alcohol content in beers.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"27 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"134901638","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}
引用次数: 0
Chemistry, Synthesis, and Structure Activity Relationship of Anticancer Quinoxalines 抗癌喹诺啉类化合物的化学、合成及构效关系研究
Q3 Chemistry Pub Date : 2023-11-14 DOI: 10.3390/chemistry5040166
Mohamed F. Zayed
Quinoxaline is a fused heterocycle system of a benzene ring and pyrazine ring. It has earned considerable attention due to its importance in the field of medicinal chemistry. The system is of extensive importance due to its comprehensive array of biological activities. Quinoxaline derivatives have been used as anticancer, anticonvulsant, anti-inflammatory, antidiabetic, antioxidant, antibacterial, anti-TB, antimalarial, antiviral, anti-HIV, and many other uses. Variously substituted quinoxalines are significant therapeutic agents in the pharmaceutical industry. This review spotlights on the chemistry, physiochemical characters, synthesis, pharmaceutical products, and medicinal chemistry of various anticancer quinoxaline derivatives that were developed in the last period. It covers the period from 2016 to 2023.
喹啉是苯环和吡嗪环的融合杂环体系。由于其在药物化学领域的重要性,它已经赢得了相当大的关注。该系统具有广泛的重要性,因为它具有广泛的生物活性。喹诺啉衍生物已被用作抗癌、抗惊厥、抗炎、抗糖尿病、抗氧化、抗菌、抗结核、抗疟疾、抗病毒、抗艾滋病毒等多种用途。各种取代喹诺啉是制药工业中重要的治疗剂。本文综述了近年来开发的各种抗癌喹诺啉衍生物的化学、理化性质、合成、药物制品及药物化学等方面的研究进展。它涵盖了2016年至2023年。
{"title":"Chemistry, Synthesis, and Structure Activity Relationship of Anticancer Quinoxalines","authors":"Mohamed F. Zayed","doi":"10.3390/chemistry5040166","DOIUrl":"https://doi.org/10.3390/chemistry5040166","url":null,"abstract":"Quinoxaline is a fused heterocycle system of a benzene ring and pyrazine ring. It has earned considerable attention due to its importance in the field of medicinal chemistry. The system is of extensive importance due to its comprehensive array of biological activities. Quinoxaline derivatives have been used as anticancer, anticonvulsant, anti-inflammatory, antidiabetic, antioxidant, antibacterial, anti-TB, antimalarial, antiviral, anti-HIV, and many other uses. Variously substituted quinoxalines are significant therapeutic agents in the pharmaceutical industry. This review spotlights on the chemistry, physiochemical characters, synthesis, pharmaceutical products, and medicinal chemistry of various anticancer quinoxaline derivatives that were developed in the last period. It covers the period from 2016 to 2023.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"3 2","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"134992037","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}
引用次数: 0
Vapor-Liquid Equilibrium in the Acetic Acid-Ethanol-Ethyl Acetate-Water Quaternary System: Critical Literature Review and Thermodynamic Consistency of the Experimental Data 乙酸-乙醇-乙酸乙酯-水四元体系的气液平衡:关键文献综述和实验数据的热力学一致性
Q3 Chemistry Pub Date : 2023-11-13 DOI: 10.3390/chemistry5040165
Georgii Misikov, Maya Trofimova, Igor Prikhodko
This study presents a critical review of the experimental vapor-liquid equilibrium (VLE) data for the quaternary acetic acid-ethanol-ethyl acetate-water system and its subsystems that are reported in the literature. The thermodynamic consistency of the VLE data were verified using two integral tests: the Redlich–Kister test and the direct integration of the Gibbs–Duhem equation. The VLE data were correlated using the NRTL equation for further integration. Additionally, the reliable value of the integral derived from the direct integration of the Gibbs–Duhem equation for multicomponent systems under isothermal-isobaric conditions was estimated. This integral can be used for testing the thermodynamic consistency of experimental VLE data.
本研究对文献中报道的季乙酸-乙醇-乙酸乙酯-水体系及其子系统的实验汽液平衡(VLE)数据进行了综述。利用Redlich-Kister检验和Gibbs-Duhem方程的直接积分验证了VLE数据的热力学一致性。为了进一步整合,VLE数据使用NRTL方程进行关联。此外,估计了等温-等压条件下多组分系统Gibbs-Duhem方程直接积分的可靠值。该积分可用于检验实验汽液平衡数据的热力学一致性。
{"title":"Vapor-Liquid Equilibrium in the Acetic Acid-Ethanol-Ethyl Acetate-Water Quaternary System: Critical Literature Review and Thermodynamic Consistency of the Experimental Data","authors":"Georgii Misikov, Maya Trofimova, Igor Prikhodko","doi":"10.3390/chemistry5040165","DOIUrl":"https://doi.org/10.3390/chemistry5040165","url":null,"abstract":"This study presents a critical review of the experimental vapor-liquid equilibrium (VLE) data for the quaternary acetic acid-ethanol-ethyl acetate-water system and its subsystems that are reported in the literature. The thermodynamic consistency of the VLE data were verified using two integral tests: the Redlich–Kister test and the direct integration of the Gibbs–Duhem equation. The VLE data were correlated using the NRTL equation for further integration. Additionally, the reliable value of the integral derived from the direct integration of the Gibbs–Duhem equation for multicomponent systems under isothermal-isobaric conditions was estimated. This integral can be used for testing the thermodynamic consistency of experimental VLE data.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"16 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"136351482","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}
引用次数: 0
Recognizing New Types of Stacking Interactions by Analyzing Data in the Cambridge Structural Database 通过分析剑桥结构数据库中的数据识别新的堆叠相互作用类型
Q3 Chemistry Pub Date : 2023-11-13 DOI: 10.3390/chemistry5040164
Dušan P. Malenov, Snežana D. Zarić
Cambridge Structural Database (CSD) is the largest repository of crystal data, containing over 1.2 million crystal structures of organic, metal–organic and organometallic compounds. It is a powerful research tool in many areas, including the extensive studying of noncovalent interactions. In this review, we show how a thorough analysis of CSD crystal data resulted in recognition of novel types of stacking interactions. Even though stacking interactions were traditionally related to aromatic systems, a number of crystallographic studies have shown that nonaromatic metal–chelate rings, as well as hydrogen-bridged rings, can also form stacking interactions. Joined efforts of a CSD analysis and quantum chemical calculations showed that these new stacking interactions are stronger than stacking interactions of aromatic species and recognized them as very important attractive forces in numerous supramolecular systems.
剑桥结构数据库(CSD)是最大的晶体数据存储库,包含超过120万个有机、金属有机和有机金属化合物的晶体结构。它是许多领域强有力的研究工具,包括非共价相互作用的广泛研究。在这篇综述中,我们展示了如何对CSD晶体数据进行彻底的分析,从而识别出新型的堆叠相互作用。尽管堆叠相互作用传统上与芳香体系有关,但许多晶体学研究表明,非芳香金属螯合环以及氢桥环也可以形成堆叠相互作用。CSD分析和量子化学计算的共同努力表明,这些新的堆叠相互作用比芳香物质的堆叠相互作用更强,并认为它们是许多超分子体系中非常重要的吸引力。
{"title":"Recognizing New Types of Stacking Interactions by Analyzing Data in the Cambridge Structural Database","authors":"Dušan P. Malenov, Snežana D. Zarić","doi":"10.3390/chemistry5040164","DOIUrl":"https://doi.org/10.3390/chemistry5040164","url":null,"abstract":"Cambridge Structural Database (CSD) is the largest repository of crystal data, containing over 1.2 million crystal structures of organic, metal–organic and organometallic compounds. It is a powerful research tool in many areas, including the extensive studying of noncovalent interactions. In this review, we show how a thorough analysis of CSD crystal data resulted in recognition of novel types of stacking interactions. Even though stacking interactions were traditionally related to aromatic systems, a number of crystallographic studies have shown that nonaromatic metal–chelate rings, as well as hydrogen-bridged rings, can also form stacking interactions. Joined efforts of a CSD analysis and quantum chemical calculations showed that these new stacking interactions are stronger than stacking interactions of aromatic species and recognized them as very important attractive forces in numerous supramolecular systems.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"143 12","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"136351488","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}
引用次数: 0
Synthesis, Characterization and Photophysical Properties of Mixed Ligand (η3-Allyl)palladium(II) Complexes with N,N’Aromatic Diimines N,N '芳二亚胺混合配体(η - 3-烯丙基)钯(II)配合物的合成、表征及光物理性质
Q3 Chemistry Pub Date : 2023-11-12 DOI: 10.3390/chemistry5040162
Antonia Garypidou, Konstantinos Ypsilantis, Evaggelia Sifnaiou, Maria Manthou, Dimitris Thomos, John C. Plakatouras, Theodoros Tsolis, Achilleas Garoufis
Palladium(II) complexes of the general formula [Pd(η3-C3H5)(L)](PF6), where L is 4,7-diphenyl-1,10-phenanthroline (1), 2,9-dimethyl-1,10-phenanthroline (2), 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline (3), 5-methyl-1,10-phenanthroline (4), 3,4,7,8-tetramethyl-1,10-phenanthroline (5), and 2-(2′-pyridyl) quinoxaline (6), were synthesized and characterized using high-resolution ESI-MS, NMR techniques and, in the case of (6), single-crystal X-ray diffraction methods. In addition, their photophysical properties were investigated. Complexes (1)–(6) were emitted in the greenish-blue region, with those containing methyl-substituted phenanthrolines having the higher quantum yield (≈14%) in the solid state.
合成了具有通式[Pd(η3-C3H5)(L)](PF6)的钯(II)配合物,其中L为4,7-二苯基-1,10-菲罗啉(1)、2,9-二甲基-1,10-菲罗啉(2)、2,9-二甲基-4,7-菲罗啉(3)、5-甲基-1,10-菲罗啉(4)、3,4,7,8-四甲基-1,10-菲罗啉(5)和2-(2 ' -吡啶基)喹啉(6),并利用高分辨率ESI-MS、NMR技术和(6)单晶x射线衍射方法对其进行了表征。此外,还研究了它们的光物理性质。配合物(1)-(6)在绿蓝色区域发射,其中含有甲基取代菲罗啉的配合物在固体状态下具有较高的量子产率(≈14%)。
{"title":"Synthesis, Characterization and Photophysical Properties of Mixed Ligand (η3-Allyl)palladium(II) Complexes with N,N’Aromatic Diimines","authors":"Antonia Garypidou, Konstantinos Ypsilantis, Evaggelia Sifnaiou, Maria Manthou, Dimitris Thomos, John C. Plakatouras, Theodoros Tsolis, Achilleas Garoufis","doi":"10.3390/chemistry5040162","DOIUrl":"https://doi.org/10.3390/chemistry5040162","url":null,"abstract":"Palladium(II) complexes of the general formula [Pd(η3-C3H5)(L)](PF6), where L is 4,7-diphenyl-1,10-phenanthroline (1), 2,9-dimethyl-1,10-phenanthroline (2), 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline (3), 5-methyl-1,10-phenanthroline (4), 3,4,7,8-tetramethyl-1,10-phenanthroline (5), and 2-(2′-pyridyl) quinoxaline (6), were synthesized and characterized using high-resolution ESI-MS, NMR techniques and, in the case of (6), single-crystal X-ray diffraction methods. In addition, their photophysical properties were investigated. Complexes (1)–(6) were emitted in the greenish-blue region, with those containing methyl-substituted phenanthrolines having the higher quantum yield (≈14%) in the solid state.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"36 40","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"135038507","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}
引用次数: 0
Unusual Phase Behaviour for Organo-Halide Perovskite Nanoparticles Synthesized via Reverse Micelle Templating 反胶束模板法合成有机卤化物钙钛矿纳米颗粒的异常相行为
Q3 Chemistry Pub Date : 2023-11-12 DOI: 10.3390/chemistry5040163
Muhammad Munir, Arsani Salib, Lok Shu Hui, Ayse Turak
Micelle templating has emerged as a powerful method to produce monodisperse nanoparticles. Herein, we explore unconventional phase transformations in the synthesis of organo-halide perovskite nanoparticles utilizing reverse micelle templates. We employ diblock-copolymer reverse micelles to fabricate these nanoparticles, which confines ions within micellar nanoreactors, retarding reaction kinetics and facilitating perovskite cage manipulation. The confined micellar environment exerts pressure on both precursors and perovskite crystals formed inside, enabling stable phases not typically observed at room temperature in conventional synthesis. This provides access to perovskite structures that are otherwise challenging to produce. The hydrophobic shell of the micelle also enhances perovskite stability, particularly when combined with anionic exchange approaches or large aromatic cations. This synergy results in long-lasting stable optical properties despite environmental exposure. Reverse micelle templates offer a versatile platform for modulating perovskite structure and behavior across a broad spectrum of perovskite compositions, yielding unique phases with diverse emission characteristics. By manipulating the composition and properties of the reverse micelle template, it is possible to tune the characteristics of the resulting nanoparticles, opening up exciting opportunities for customizing optical properties to suit various applications.
胶束模板法是制备单分散纳米颗粒的一种有效方法。在此,我们探索了利用反胶束模板合成有机卤化物钙钛矿纳米颗粒的非常规相变。我们使用双嵌段共聚物反胶束来制造这些纳米颗粒,这将离子限制在胶束纳米反应器内,延缓反应动力学并促进钙钛矿笼操作。封闭的胶束环境对前驱体和内部形成的钙钛矿晶体施加压力,使传统合成中在室温下通常观察不到的稳定相成为可能。这为钙钛矿结构的生产提供了途径,否则将具有挑战性。胶束的疏水外壳也增强了钙钛矿的稳定性,特别是当与阴离子交换方法或大的芳香阳离子结合时。这种协同作用导致持久稳定的光学性能,尽管环境暴露。反向胶束模板为调节钙钛矿的结构和行为提供了一个通用的平台,通过广泛的钙钛矿成分,产生具有不同发射特性的独特相。通过操纵反向胶束模板的组成和性质,可以调整所得到的纳米颗粒的特性,为定制光学性质以适应各种应用开辟了令人兴奋的机会。
{"title":"Unusual Phase Behaviour for Organo-Halide Perovskite Nanoparticles Synthesized via Reverse Micelle Templating","authors":"Muhammad Munir, Arsani Salib, Lok Shu Hui, Ayse Turak","doi":"10.3390/chemistry5040163","DOIUrl":"https://doi.org/10.3390/chemistry5040163","url":null,"abstract":"Micelle templating has emerged as a powerful method to produce monodisperse nanoparticles. Herein, we explore unconventional phase transformations in the synthesis of organo-halide perovskite nanoparticles utilizing reverse micelle templates. We employ diblock-copolymer reverse micelles to fabricate these nanoparticles, which confines ions within micellar nanoreactors, retarding reaction kinetics and facilitating perovskite cage manipulation. The confined micellar environment exerts pressure on both precursors and perovskite crystals formed inside, enabling stable phases not typically observed at room temperature in conventional synthesis. This provides access to perovskite structures that are otherwise challenging to produce. The hydrophobic shell of the micelle also enhances perovskite stability, particularly when combined with anionic exchange approaches or large aromatic cations. This synergy results in long-lasting stable optical properties despite environmental exposure. Reverse micelle templates offer a versatile platform for modulating perovskite structure and behavior across a broad spectrum of perovskite compositions, yielding unique phases with diverse emission characteristics. By manipulating the composition and properties of the reverse micelle template, it is possible to tune the characteristics of the resulting nanoparticles, opening up exciting opportunities for customizing optical properties to suit various applications.","PeriodicalId":9850,"journal":{"name":"Chemistry","volume":"24 6","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"135037048","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}
引用次数: 0
期刊
Chemistry
全部 Acc. Chem. Res. ACS Applied Bio Materials ACS Appl. Electron. Mater. ACS Appl. Energy Mater. ACS Appl. Mater. Interfaces ACS Appl. Nano Mater. ACS Appl. Polym. Mater. ACS BIOMATER-SCI ENG ACS Catal. ACS Cent. Sci. ACS Chem. Biol. ACS Chemical Health & Safety ACS Chem. Neurosci. ACS Comb. Sci. ACS Earth Space Chem. ACS Energy Lett. ACS Infect. Dis. ACS Macro Lett. ACS Mater. Lett. ACS Med. Chem. Lett. ACS Nano ACS Omega ACS Photonics ACS Sens. ACS Sustainable Chem. Eng. ACS Synth. Biol. Anal. Chem. BIOCHEMISTRY-US Bioconjugate Chem. BIOMACROMOLECULES Chem. Res. Toxicol. Chem. Rev. Chem. Mater. CRYST GROWTH DES ENERG FUEL Environ. Sci. Technol. Environ. Sci. Technol. Lett. Eur. J. Inorg. Chem. IND ENG CHEM RES Inorg. Chem. J. Agric. Food. Chem. J. Chem. Eng. Data J. Chem. Educ. J. Chem. Inf. Model. J. Chem. Theory Comput. J. Med. Chem. J. Nat. Prod. J PROTEOME RES J. Am. Chem. Soc. LANGMUIR MACROMOLECULES Mol. Pharmaceutics Nano Lett. Org. Lett. ORG PROCESS RES DEV ORGANOMETALLICS J. Org. Chem. J. Phys. Chem. J. Phys. Chem. A J. Phys. Chem. B J. Phys. Chem. C J. Phys. Chem. Lett. Analyst Anal. Methods Biomater. Sci. Catal. Sci. Technol. Chem. Commun. Chem. Soc. Rev. CHEM EDUC RES PRACT CRYSTENGCOMM Dalton Trans. Energy Environ. Sci. ENVIRON SCI-NANO ENVIRON SCI-PROC IMP ENVIRON SCI-WAT RES Faraday Discuss. Food Funct. Green Chem. Inorg. Chem. Front. Integr. Biol. J. Anal. At. Spectrom. J. Mater. Chem. A J. Mater. Chem. B J. Mater. Chem. C Lab Chip Mater. Chem. Front. Mater. Horiz. MEDCHEMCOMM Metallomics Mol. Biosyst. Mol. Syst. Des. Eng. Nanoscale Nanoscale Horiz. Nat. Prod. Rep. New J. Chem. Org. Biomol. Chem. Org. Chem. Front. PHOTOCH PHOTOBIO SCI PCCP Polym. Chem.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1