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Study on the adsorption performance of zeolite imidazole frameworks materials for Co(II) and Mn(II) in solution 沸石咪唑框架材料对溶液中 Co(II) 和 Mn(II) 的吸附性能研究
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-24 DOI: 10.1515/ract-2024-0274
Ping Bao, Yipeng Zhou, Xiaowei Wang, Jinfeng Men, Chengqiang Liang, Hao Ding
The radionuclides 60Co and 54Mn are the main activation products produced in the operation of nuclear power facilities. Wastewater with these radionuclides must be treated to meet standards before being discharged. A variety of zeolite imidazole frameworks (ZIFs) materials were synthesized at room temperature, and the adsorption effect of ZIF-67 was found to be the best through adsorption experiments on Co(II) and Mn(II). The thermal stability test and structural characterization of ZIF-67 were carried out. At the same time, the influence of the initial pH value, adsorption time, and initial concentration of the solution on the adsorption of Co(II) and Mn(II) by ZIF-67 was investigated. The results show that: ZIF-67 has a microporous structure with a BET surface area of 1,035.72 m2/g. In addition, ZIF-67 has good thermal stability, under the condition of pH = 6, a temperature of 303 K and the initial concentration of 500 mg/L. The saturated adsorption capacity for Co(II) and Mn(II) reached 230.25 mg/g and 338.75 mg/g, respectively. ZIF-67 exhibits good selective adsorption performance for Co(II) and Mn (II) in high concentration interfering ion solutions and multi-ion solutions. The adsorption process of ZIF-67 was analyzed by kinetics, thermodynamics, isotherms, and adsorption diffusion models. The analysis of thermodynamic parameters shows that the adsorption process of ZIF-67 to Co(II) and Mn(II) is spontaneous and endothermic. The pseudo-second-order kinetic model, Langmuir isotherm model, and Boyd model are more in line with the adsorption process of Co(II) and Mn(II) by ZIF-67. It shows that the active sites on the surface of ZIF-67 are evenly distributed, and the adsorption process is single-molecule chemical layer adsorption. In addition, the liquid film diffusion dominates the adsorption rate during the adsorption process of Co(II) and Mn(II) by ZIF-67.
放射性核素 60Co 和 54Mn 是核电设施运行过程中产生的主要活化产物。含有这些放射性核素的废水必须经过处理才能达标排放。在室温下合成了多种沸石咪唑框架(ZIFs)材料,通过对Co(II)和Mn(II)的吸附实验发现,ZIF-67的吸附效果最好。对 ZIF-67 进行了热稳定性测试和结构表征。同时,研究了初始 pH 值、吸附时间和溶液初始浓度对 ZIF-67 吸附 Co(II) 和 Mn(II) 的影响。结果表明ZIF-67 具有微孔结构,其 BET 表面积为 1,035.72 m2/g。此外,在 pH = 6、温度为 303 K 和初始浓度为 500 mg/L 的条件下,ZIF-67 具有良好的热稳定性。对钴(II)和锰(II)的饱和吸附容量分别达到 230.25 mg/g 和 338.75 mg/g。在高浓度干扰离子溶液和多离子溶液中,ZIF-67 对钴(II)和锰(II)具有良好的选择性吸附性能。通过动力学、热力学、等温线和吸附扩散模型分析了 ZIF-67 的吸附过程。热力学参数分析表明,ZIF-67 对 Co(II) 和 Mn(II) 的吸附过程是自发的、内热的。伪二阶动力学模型、Langmuir 等温线模型和 Boyd 模型更符合 ZIF-67 对 Co(II) 和 Mn(II) 的吸附过程。这表明 ZIF-67 表面的活性位点分布均匀,吸附过程为单分子化学层吸附。此外,在 ZIF-67 吸附 Co(II) 和 Mn(II) 的过程中,液膜扩散主导了吸附速率。
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引用次数: 0
Measurement of gross alpha radioactivity levels and estimation of annual effective dose in hazelnut kernels 榛子核仁中总α放射性水平的测量和年有效剂量的估算
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-22 DOI: 10.1515/ract-2023-0224
Gözde Tektaş, Buket Canbaz Öztürk
The present study investigates gross alpha (GA) radioactivity levels in hazelnut kernels purchased from markets in Türkiye. 10 different hazelnut samples were crushed and made ready for counting. The alpha counts were obtained via ELSEC 7286 low level alpha counter with ZnS scintillator and EMI 6097B photomultiplier tube. The samples were placed in front of the detector to acquire the counts. All samples were counted isochronously. In addition to the GA activity measurement, total annual effective dose (AED) value for different age groups owing to ingestion was calculated for each sample. It was observed that the GA radioactivity levels in the samples were quite low, and total AED values were considerably lower than the WHO worldwide average AED value (290 μSv/year).
本研究调查了从土耳其市场上购买的榛子核仁中的总α(GA)放射性水平。10 个不同的榛子样本被粉碎并准备进行计数。α计数是通过配有 ZnS 闪烁器和 EMI 6097B 光电倍增管的 ELSEC 7286 低浓度α计数器获得的。将样品放在探测器前进行计数。所有样品都是等时计数。除了测量γ-氨基甲酸乙酯的放射性活度外,还计算了每个样本在不同年 龄组别摄入γ-氨基甲酸乙酯后每年的总有效剂量值。结果显示,样本的γ-基因活度水平相当低,而总有效剂量值则大大低于世界卫生组织的全球平均有效剂量值(290 微希/年)。
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引用次数: 0
Independent isomeric yield ratios of fission products in the epi-cadmium neutron-induced fission of 245Cm 245Cm 外镉中子诱发裂变中裂变产物的独立异构体产率
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-18 DOI: 10.1515/ract-2024-0287
Haladhara Naik, Ram Janam Singh, Srikant Pandurang Dange, Wooyoung Jang
Independent isomeric yield ratios (IR) of 128,130,132Sb, 131,133Te, 132,134I, 135Xe and 138Cs in the epi-cadmium neutron-induced fission of 245Cm have been measured for the first time by using an off-line gamma-ray spectrometric technique. The average energy of the epi-cadmium neutron spectrum (<E n >) is 1.9 MeV. From the IR values, root mean square fragment angular momenta (J RMS) were deduced by using the spin dependent statistical model analysis. The IR and JRMS values of the fission products from the present work were compared with the literature data in the thermal neutron-induced fission of 245Cm to examine the role of excitation energy. Effect of nuclear structure on J RMS value was also examined.
利用离线伽马射线光谱技术,首次测量了表镉中子诱导 245Cm 裂变中 128、130、132Sb、131、133Te、132、134I、135Xe 和 138Cs 的独立异构体产率(IR)。表镉中子谱的平均能量(<E n >)为 1.9 MeV。通过自旋相关统计模型分析,从红外值推导出了均方根碎片角矩(J RMS)。本研究中裂变产物的红外值和 JRMS 值与 245Cm 热中子诱发裂变的文献数据进行了比较,以研究激发能的作用。此外,还研究了核结构对 J RMS 值的影响。
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引用次数: 0
Hydrodynamic study of a flow-rig column by means of a radiotracer technique modelling with DTS-Pro 4 利用 DTS-Pro 4 进行放射性示踪技术建模,对流动钻杆柱进行流体力学研究
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-11 DOI: 10.1515/ract-2023-0227
Louisa Bounemia, Chaouki Benazzouz, Mouhamed Belamri
The residence time distribution (RTD) is very reliable, providing valuable information about the performance of process equipment such as reactors and columns. The aim of this work is to study the effect of agitation in the hydrodynamic column of flow-rig. In this case, residence time distribution (RTD) is determined using the radiotracer approach. The radiotracer is the Technetium Tc-99m with half decay 6 h. It also emits gamma rays with an energy of 0.140 MeV. 2 mL of approximately 9 mCi activity Tc-99m was injected inside the column. The results show that in the conditions studied the column presents the anomaly, dead volume. The Intensity function A(t) confirms this result. Agitation has a beneficial effect in the reduction of dead volume. To revise the conception of the column or study other parameters like the variation flow rate can reduce or eliminate the dead volume. The RTD model indicated the column behaved as a Plug flow reactor (PFR) with mixing cells in serie (J = 4) model and the RTD experiment verified the model well.
停留时间分布(RTD)非常可靠,可为反应器和塔等工艺设备的性能提供有价值的信息。这项工作的目的是研究流动钻机流体动力柱中搅拌的影响。在这种情况下,采用放射性示踪剂方法确定停留时间分布(RTD)。放射性示踪剂是半衰期为 6 h 的锝 Tc-99m,它还能发射能量为 0.140 MeV 的伽马射线。2 mL 约 9 mCi 活性的 Tc-99m 被注入色谱柱内。结果表明,在所研究的条件下,色谱柱出现了异常,即死体积。强度函数 A(t) 证实了这一结果。搅拌对减少死体积有好处。修改色谱柱的设计或研究其他参数(如变化流速)可以减少或消除死体积。热电阻模型表明,色谱柱表现为带有串联(J = 4)混合单元的塞流反应器(PFR)模型,热电阻实验很好地验证了该模型。
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引用次数: 0
Physicochemical model of uranium hexafluoride (UF6) radiolysis under action of alpha particles 六氟化铀(UF6)在α粒子作用下发生辐射分解的物理化学模型
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-09 DOI: 10.1515/ract-2023-0263
Artem A. Danshin, Alexey A. Kovalishin
A multiscale model describing the kinetics of the processes taking place during the radiolysis of uranium hexafluoride (UF6) has been developed using fundamental physical and chemical principles. The model incorporates both the radiolysis and thermal terms. The processes of the radiolysis products release from the gas phase to the solid and vice versa are taken into account. The predictions of the model are verified against the available experimental data.
利用基本物理和化学原理开发了一个描述六氟化铀(UF6)辐射分解过程动力学的多尺度模型。该模型包含了辐射分解和热效应两个方面。模型还考虑了放射性分解产物从气相释放到固态以及从固态释放到气相的过程。该模型的预测结果与现有的实验数据进行了验证。
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引用次数: 0
Fabrication and characterization of graphene oxide and reduced graphene oxide decorated diatomite composite materials and their adsorption performance for uranium ions 氧化石墨烯和还原氧化石墨烯装饰硅藻土复合材料的制备与表征及其对铀离子的吸附性能
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-07 DOI: 10.1515/ract-2024-0292
Sabriye Yusan, Burak Mumcu, Eduardo A. López-Maldonado, Rachid EL Kaim Billah, Lahoucine Bahsis
In this study, the composite materials based on the incorporation of diatomite of graphene oxide (GO)/reduced graphene oxide (rGO/diatomite) were developed and characterized by different techniques (SEM, XRD, FTIR and BET). Developed composites were used for the first time in the removal of uranium ions from aqueous solutions. In adsorption studies, parameters affecting the adsorption efficiency such as solution pH, temperature, contact time and initial U(VI) concentration were investigated using full factorial experimental design (FFED). ANOVA (analysis of variance) analysis within the 95 % confidence interval of the model applied to control the compatibility of the model and the experimental findings was examined. Langmuir, Freundlich and Temkin isotherms were used to determine the adsorption model and related parameters were calculated. In addition, adsorption thermodynamic parameters such as enthalpy, Gibbs free energy change and entropy were calculated. The uranium removal behaviour on GO/diatomite and rGO/diatomite was better characterized by the pseudo-second order and Langmuir models, indicating that uranium ions were chemically adsorbed onto composite materials. Additionally, it was observed that higher temperatures promoted the uranium removal on GO/diatomite and rGO/diatomite, suggesting that the removal process was a spontaneous endothermic and exothermic reaction, respectively. In addition, the adsorption of U(VI) with GO/diatomite and rGO/diatomite was investigated using density functional theory (DFT) study. Configuration and adsorption energy were determined. The GO/diatomite composite materials can be a promising candidate as an adsorbent for the removal of uranium from aqueous solutions.
本研究开发了基于硅藻土的氧化石墨烯(GO)/还原氧化石墨烯(rGO/硅藻土)复合材料,并通过不同的技术(SEM、XRD、FTIR 和 BET)对其进行了表征。开发的复合材料首次用于去除水溶液中的铀离子。在吸附研究中,使用全因子实验设计(FFED)研究了影响吸附效率的参数,如溶液 pH 值、温度、接触时间和初始铀(VI)浓度。在模型的 95% 置信区间内进行方差分析,以控制模型与实验结果的兼容性。利用 Langmuir、Freundlich 和 Temkin 等温线确定了吸附模型,并计算了相关参数。此外,还计算了吸附热力学参数,如焓、吉布斯自由能变化和熵。假二阶模型和 Langmuir 模型较好地描述了 GO/diatomite 和 rGO/diatomite 上的铀去除行为,表明铀离子在复合材料上被化学吸附。此外,还观察到较高的温度促进了 GO/diatomite 和 rGO/diatomite 上铀的去除,这表明去除过程分别是自发的内热和放热反应。此外,还利用密度泛函理论(DFT)研究了 U(VI) 在 GO/diatomite 和 rGO/diatomite 上的吸附情况。确定了构型和吸附能。GO/硅藻土复合材料有望成为从水溶液中去除铀的吸附剂。
{"title":"Fabrication and characterization of graphene oxide and reduced graphene oxide decorated diatomite composite materials and their adsorption performance for uranium ions","authors":"Sabriye Yusan, Burak Mumcu, Eduardo A. López-Maldonado, Rachid EL Kaim Billah, Lahoucine Bahsis","doi":"10.1515/ract-2024-0292","DOIUrl":"https://doi.org/10.1515/ract-2024-0292","url":null,"abstract":"In this study, the composite materials based on the incorporation of diatomite of graphene oxide (GO)/reduced graphene oxide (rGO/diatomite) were developed and characterized by different techniques (SEM, XRD, FTIR and BET). Developed composites were used for the first time in the removal of uranium ions from aqueous solutions. In adsorption studies, parameters affecting the adsorption efficiency such as solution pH, temperature, contact time and initial U(VI) concentration were investigated using full factorial experimental design (FFED). ANOVA (analysis of variance) analysis within the 95 % confidence interval of the model applied to control the compatibility of the model and the experimental findings was examined. Langmuir, Freundlich and Temkin isotherms were used to determine the adsorption model and related parameters were calculated. In addition, adsorption thermodynamic parameters such as enthalpy, Gibbs free energy change and entropy were calculated. The uranium removal behaviour on GO/diatomite and rGO/diatomite was better characterized by the pseudo-second order and Langmuir models, indicating that uranium ions were chemically adsorbed onto composite materials. Additionally, it was observed that higher temperatures promoted the uranium removal on GO/diatomite and rGO/diatomite, suggesting that the removal process was a spontaneous endothermic and exothermic reaction, respectively. In addition, the adsorption of U(VI) with GO/diatomite and rGO/diatomite was investigated using density functional theory (DFT) study. Configuration and adsorption energy were determined. The GO/diatomite composite materials can be a promising candidate as an adsorbent for the removal of uranium from aqueous solutions.","PeriodicalId":21167,"journal":{"name":"Radiochimica Acta","volume":null,"pages":null},"PeriodicalIF":1.8,"publicationDate":"2024-07-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141569033","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Preparation of MnO2 modified winter melon-derived biochar for enhanced adsorption of U(VI) from aqueous solution 制备 MnO2 改性冬瓜生物炭以增强水溶液中 U(VI) 的吸附能力
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-07 DOI: 10.1515/ract-2024-0301
Qing Zhou, Yanjun Du, Zihao Feng, Qi Ren, Yang Wang, Xiaoyong Chen, Yang Li, Yun Wang
This work synthesized MnO2 modified winter melon-derived biochar (MnO2@WBC) using potassium permanganate oxidation/hydrothermal method for uranium(VI) removal. The factors influencing uranium(VI) adsorption by MnO2@WBC, including pH, adsorbent dosage, time, temperature, and initial U(VI) concentration were explored. The material’s performance was characterized, and the underlying mechanism of U(VI) removal was analyzed using various techniques. The characterization results indicated that the MnO2@WBC exhibited excellent dispersibility, suggesting that MnO2 effectively prevented WBC aggregation and enhanced the reactive surface area, and providing more active sites that can effectively promote the complexation and adsorption of U(VI). The process suggested a dominant role for chemical adsorption. The Freundlich isotherm model demonstrated a high degree of alignment with the observed adsorption behavior, indicating a predominantly multilayer adsorption process. Thermodynamic studies indicated that adsorption was a spontaneous endothermic process. The XPS analysis demonstrated that the adsorption process was primarily due to the formation of stable complexes with C–O, Mn–O–H and C=O. The results demonstrated that MnO2@WBC effectively removed U(VI), achieving a maximum adsorption capacity of 240.86 mg g−1 at a pH of 5.0. These findings provided a theoretical basis for the treatment of wastewater contaminated with U(VI).
本研究采用高锰酸钾氧化/水热法合成了二氧化锰修饰的冬瓜生物炭(MnO2@WBC),用于去除铀(VI)。研究了影响 MnO2@WBC 吸附铀(VI)的因素,包括 pH 值、吸附剂用量、时间、温度和初始铀(VI)浓度。对该材料的性能进行了表征,并使用多种技术分析了其去除铀(VI)的内在机理。表征结果表明,MnO2@WBC 具有良好的分散性,表明 MnO2 有效阻止了 WBC 的聚集,提高了反应表面积,提供了更多的活性位点,能有效促进 U(VI) 的络合和吸附。该过程表明化学吸附起主导作用。Freundlich 等温线模型与观察到的吸附行为高度吻合,表明吸附过程主要是多层吸附。热力学研究表明,吸附是一个自发的内热过程。XPS 分析表明,吸附过程主要是由于 C-O、Mn-O-H 和 C=O 形成了稳定的络合物。结果表明,MnO2@WBC 能有效地去除铀(VI),在 pH 值为 5.0 时的最大吸附容量为 240.86 mg g-1。这些发现为处理受铀(VI)污染的废水提供了理论依据。
{"title":"Preparation of MnO2 modified winter melon-derived biochar for enhanced adsorption of U(VI) from aqueous solution","authors":"Qing Zhou, Yanjun Du, Zihao Feng, Qi Ren, Yang Wang, Xiaoyong Chen, Yang Li, Yun Wang","doi":"10.1515/ract-2024-0301","DOIUrl":"https://doi.org/10.1515/ract-2024-0301","url":null,"abstract":"This work synthesized MnO<jats:sub>2</jats:sub> modified winter melon-derived biochar (MnO<jats:sub>2</jats:sub>@WBC) using potassium permanganate oxidation/hydrothermal method for uranium(VI) removal. The factors influencing uranium(VI) adsorption by MnO<jats:sub>2</jats:sub>@WBC, including pH, adsorbent dosage, time, temperature, and initial U(VI) concentration were explored. The material’s performance was characterized, and the underlying mechanism of U(VI) removal was analyzed using various techniques. The characterization results indicated that the MnO<jats:sub>2</jats:sub>@WBC exhibited excellent dispersibility, suggesting that MnO<jats:sub>2</jats:sub> effectively prevented WBC aggregation and enhanced the reactive surface area, and providing more active sites that can effectively promote the complexation and adsorption of U(VI). The process suggested a dominant role for chemical adsorption. The Freundlich isotherm model demonstrated a high degree of alignment with the observed adsorption behavior, indicating a predominantly multilayer adsorption process. Thermodynamic studies indicated that adsorption was a spontaneous endothermic process. The XPS analysis demonstrated that the adsorption process was primarily due to the formation of stable complexes with C–O, Mn–O–H and C=O. The results demonstrated that MnO<jats:sub>2</jats:sub>@WBC effectively removed U(VI), achieving a maximum adsorption capacity of 240.86 mg g<jats:sup>−1</jats:sup> at a pH of 5.0. These findings provided a theoretical basis for the treatment of wastewater contaminated with U(VI).","PeriodicalId":21167,"journal":{"name":"Radiochimica Acta","volume":null,"pages":null},"PeriodicalIF":1.8,"publicationDate":"2024-07-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141569032","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Synthesis, in silico and biodistribution studies of a novel 47Sc-radiolabeled α-amino acid ester derivative attached to pyrazine and tetrazole rings for tumor targeted radiotherapy 用于肿瘤靶向放射治疗的新型 47Sc 放射标记α-氨基酸酯衍生物的合成、硅学和生物分布研究
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-07-04 DOI: 10.1515/ract-2023-0175
Mohamed A. Gizawy, Hesham A. Shamsel-Din, Mohsen M. T. El-Tahawy, Ayman A. Ibrahim
Recently, tumor-targeted radionuclide therapy has gained much recognition for the treatment of metastasized cancer. There is a growing interest in using the theranostic radionuclide 47Sc, owing to its excellent chemical and nuclear properties. However, the available chelating agents require a relatively high temperature for their radiolabeling, which could denature biomolecules. The aim of the present study is to synthesize a dipeptide agent that forms a thermodynamically more stable complex with 47Sc at room temperature. A novel α-amino acid ester derivative attached to pyrazine and tetrazole heterocyclic rings has been prepared by the azide coupling method. Different spectroscopic methods (FT-IR, 1H NMR, and mass spectra) were used for characterization of the target compound. The newly synthesized dipeptide was radiolabeled with 47Sc, and a high radiochemical yield of 98.5 ± 1.5 % and in vitro serum stability up to 72 h were attained at room temperature within 20 min. The quantum chemical calculations at B3PW91/6-31G(d) level were employed to establish the molecular structure of the dipeptide and its complexation with 47Sc. The selectivity of 47Sc-dipeptide toward localization in tumor cells was performed by molecular docking on different receptors in addition to in vivo biodistribution on solid tumor-bearing mice. A high T/NT ratio of 8.16 was obtained after 4 h p.i, suggesting that this complex could be used as a potential cancer theranostic agent.
最近,肿瘤靶向放射性核素疗法在治疗转移性癌症方面获得了广泛认可。由于 47Sc 具有优异的化学和核特性,人们对使用治疗放射性核素的兴趣与日俱增。然而,现有的螯合剂需要在相对较高的温度下进行放射性标记,这可能会使生物大分子变性。本研究的目的是合成一种能在室温下与 47Sc 形成热力学上更稳定的复合物的二肽剂。本研究采用叠氮偶联法制备了一种新型α-氨基酸酯衍生物,该衍生物附着在吡嗪和四唑杂环上。目标化合物的表征采用了不同的光谱方法(傅立叶变换红外光谱、1H NMR 和质谱)。用 47Sc 对新合成的二肽进行了放射性标记,在室温下 20 分钟内达到了 98.5 ± 1.5 % 的高放射化学收率和长达 72 小时的体外血清稳定性。通过 B3PW91/6-31G(d) 水平的量子化学计算,建立了二肽的分子结构及其与 47Sc 的复合物。除了在实体瘤小鼠体内的生物分布外,还通过与不同受体的分子对接研究了 47Sc 二肽在肿瘤细胞中的定位选择性。4 h p.i后,T/NT比值高达8.16,这表明该复合物可用作一种潜在的癌症治疗剂。
{"title":"Synthesis, in silico and biodistribution studies of a novel 47Sc-radiolabeled α-amino acid ester derivative attached to pyrazine and tetrazole rings for tumor targeted radiotherapy","authors":"Mohamed A. Gizawy, Hesham A. Shamsel-Din, Mohsen M. T. El-Tahawy, Ayman A. Ibrahim","doi":"10.1515/ract-2023-0175","DOIUrl":"https://doi.org/10.1515/ract-2023-0175","url":null,"abstract":"Recently, tumor-targeted radionuclide therapy has gained much recognition for the treatment of metastasized cancer. There is a growing interest in using the theranostic radionuclide <jats:sup>47</jats:sup>Sc, owing to its excellent chemical and nuclear properties. However, the available chelating agents require a relatively high temperature for their radiolabeling, which could denature biomolecules. The aim of the present study is to synthesize a dipeptide agent that forms a thermodynamically more stable complex with <jats:sup>47</jats:sup>Sc at room temperature. A novel <jats:italic>α</jats:italic>-amino acid ester derivative attached to pyrazine and tetrazole heterocyclic rings has been prepared by the azide coupling method. Different spectroscopic methods (FT-IR, <jats:sup>1</jats:sup>H NMR, and mass spectra) were used for characterization of the target compound. The newly synthesized dipeptide was radiolabeled with <jats:sup>47</jats:sup>Sc, and a high radiochemical yield of 98.5 ± 1.5 % and <jats:italic>in vitro</jats:italic> serum stability up to 72 h were attained at room temperature within 20 min. The quantum chemical calculations at B3PW91/6-31G(d) level were employed to establish the molecular structure of the dipeptide and its complexation with <jats:sup>47</jats:sup>Sc. The selectivity of <jats:sup>47</jats:sup>Sc-dipeptide toward localization in tumor cells was performed by molecular docking on different receptors in addition to <jats:italic>in vivo</jats:italic> biodistribution on solid tumor-bearing mice. A high T/NT ratio of 8.16 was obtained after 4 h p.i, suggesting that this complex could be used as a potential cancer theranostic agent.","PeriodicalId":21167,"journal":{"name":"Radiochimica Acta","volume":null,"pages":null},"PeriodicalIF":1.8,"publicationDate":"2024-07-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141552516","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Separation studies of 60Co (II) and 134Cs (I) radionuclides from aqueous solution using starch-grafted citric acid-acrylamide/magnesia hydrogel 利用淀粉接枝柠檬酸-丙烯酰胺/镁水凝胶从水溶液中分离 60Co (II) 和 134Cs (I) 放射性核素的研究
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-06-24 DOI: 10.1515/ract-2024-0295
Maha Ali Youssef, Gehan Abdel Rahman Sadek Dakroury, Hisham Soliman Hassan
In this study, three starch hydrogels composite prepared using different ratios of starch, citric acid, acrylamide, and MgO nanoparticles (referred to as St1-g-(CA-AM), St2-g-(CA-AM), and St3-g-(CA-AM) MgO). These materials were assessed using FT-IR, SEM, and EDX. The adsorption of 134Cs(I) and 60Co (II) onto these materials studied using radiometric analysis. The investigation focused on how temperature, contact duration, initial metal ion concentration, and pH of the solution affected the sorption efficiency. It is found that a pH value of 7 optimized the adsorption reaction, reaching equilibrium after 40 minutes. The kinetics of the adsorption followed a pseudo-second order model. The Langmuir model adequately explained the sorption mechanism, supported by the analysis of isotherm models. The monolayer adsorption capacities for 60Co (II) and 134Cs (I) were 113.38 and 100.2 mg g−1, respectively. The thermodynamic study indicated that the sorption process is both endothermic and spontaneous.
本研究采用不同比例的淀粉、柠檬酸、丙烯酰胺和氧化镁纳米颗粒(简称为 St1-g-(CA-AM)、St2-g-(CA-AM)和 St3-g-(CA-AM) MgO)制备了三种淀粉水凝胶复合材料。使用傅立叶变换红外光谱(FT-IR)、扫描电子显微镜(SEM)和电离辐射显微镜(EDX)对这些材料进行了评估。使用辐射分析法研究了 134Cs(I)和 60Co(II)在这些材料上的吸附情况。研究重点是温度、接触时间、初始金属离子浓度和溶液的 pH 值如何影响吸附效率。研究发现,pH 值为 7 时吸附反应最佳,40 分钟后达到平衡。吸附动力学遵循伪二阶模型。朗缪尔模型充分解释了吸附机理,等温线模型的分析也为其提供了支持。60Co (II) 和 134Cs (I) 的单层吸附容量分别为 113.38 和 100.2 mg g-1。热力学研究表明,吸附过程是内热和自发的。
{"title":"Separation studies of 60Co (II) and 134Cs (I) radionuclides from aqueous solution using starch-grafted citric acid-acrylamide/magnesia hydrogel","authors":"Maha Ali Youssef, Gehan Abdel Rahman Sadek Dakroury, Hisham Soliman Hassan","doi":"10.1515/ract-2024-0295","DOIUrl":"https://doi.org/10.1515/ract-2024-0295","url":null,"abstract":"In this study, three starch hydrogels composite prepared using different ratios of starch, citric acid, acrylamide, and MgO nanoparticles (referred to as St<jats:sub>1</jats:sub>-g-(CA-AM), St<jats:sub>2</jats:sub>-g-(CA-AM), and St<jats:sub>3</jats:sub>-g-(CA-AM) MgO). These materials were assessed using FT-IR, SEM, and EDX. The adsorption of <jats:sup>134</jats:sup>Cs(I) and <jats:sup>60</jats:sup>Co (II) onto these materials studied using radiometric analysis. The investigation focused on how temperature, contact duration, initial metal ion concentration, and pH of the solution affected the sorption efficiency. It is found that a pH value of 7 optimized the adsorption reaction, reaching equilibrium after 40 minutes. The kinetics of the adsorption followed a pseudo-second order model. The Langmuir model adequately explained the sorption mechanism, supported by the analysis of isotherm models. The monolayer adsorption capacities for <jats:sup>60</jats:sup>Co (II) and <jats:sup>134</jats:sup>Cs (I) were 113.38 and 100.2 mg g<jats:sup>−1</jats:sup>, respectively. The thermodynamic study indicated that the sorption process is both endothermic and spontaneous.","PeriodicalId":21167,"journal":{"name":"Radiochimica Acta","volume":null,"pages":null},"PeriodicalIF":1.8,"publicationDate":"2024-06-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141503020","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Identification and time evolution of thionyl chloride (SOCl2) radiolysis products 亚硫酰氯(SOCl2)辐射分解产物的鉴定和时间演化
IF 1.8 3区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2024-06-21 DOI: 10.1515/ract-2024-0288
Jacy K. Conrad, Michael E. Woods, Gregory P. Horne
Innovative solutions are needed to reduce the amount of high-level waste generated by used nuclear fuel recycling strategies to support the widespread adoption of sustainable nuclear fission energy technologies. To this end, a new sulfur chloride-based process has been developed to recycle zirconium alloy-based materials, which make up a significant fraction of high-level radioactive waste. To support the continued development of this process, we present new data on the potential reaction pathways over time of the products arising from the gamma and electron beam radiolysis of neat thionyl chloride (SOCl2). Interrogation of the gamma irradiated liquid by Raman spectroscopy provided more conclusive identification of the SOCl2 degradation products, specifically sulfur dichloride (SCl2), molecular chlorine (Cl2), sulfur dioxide (SO2), and sulfuryl chloride (SO2Cl2). In comparison, the high dose rate (∼107 Gy s−1) electron beam irradiations formed significantly more degradation products. For both cobalt-60 gamma and electron beam irradiations, the observed degradation products were found to evolve as a function of time post-irradiation via the same reaction pathways, with indication of a solvent regeneration mechanism. These findings are fortuitous for process development, as such a mechanism would be beneficial for process longevity and cost effectiveness.
需要创新的解决方案来减少废旧核燃料回收战略产生的高放射性废物量,以支持可持续核裂变能源技术的广泛采用。为此,我们开发了一种基于氯化硫的新工艺,用于回收锆合金材料,这种材料在高放射性废物中占很大比例。为了支持这一工艺的持续发展,我们提供了关于纯净的亚硫酰氯(SOCl2)在伽马射线和电子束辐射分解过程中产生的产物随时间变化的潜在反应途径的新数据。利用拉曼光谱对伽马射线辐照过的液体进行分析,可以更准确地确定 SOCl2 的降解产物,特别是二氯化硫(SCl2)、分子氯(Cl2)、二氧化硫(SO2)和硫酰氯(SO2Cl2)。相比之下,高剂量率(∼107 Gy s-1)电子束辐照产生的降解产物要多得多。在钴-60 伽马辐照和电子束辐照中,观察到的降解产物都是通过相同的反应途径随辐照后时间的变化而变化的,这表明存在溶剂再生机制。这些发现对于工艺开发来说是非常幸运的,因为这种机制将有利于工艺的寿命和成本效益。
{"title":"Identification and time evolution of thionyl chloride (SOCl2) radiolysis products","authors":"Jacy K. Conrad, Michael E. Woods, Gregory P. Horne","doi":"10.1515/ract-2024-0288","DOIUrl":"https://doi.org/10.1515/ract-2024-0288","url":null,"abstract":"Innovative solutions are needed to reduce the amount of high-level waste generated by used nuclear fuel recycling strategies to support the widespread adoption of sustainable nuclear fission energy technologies. To this end, a new sulfur chloride-based process has been developed to recycle zirconium alloy-based materials, which make up a significant fraction of high-level radioactive waste. To support the continued development of this process, we present new data on the potential reaction pathways over time of the products arising from the gamma and electron beam radiolysis of neat thionyl chloride (SOCl<jats:sub>2</jats:sub>). Interrogation of the gamma irradiated liquid by Raman spectroscopy provided more conclusive identification of the SOCl<jats:sub>2</jats:sub> degradation products, specifically sulfur dichloride (SCl<jats:sub>2</jats:sub>), molecular chlorine (Cl<jats:sub>2</jats:sub>), sulfur dioxide (SO<jats:sub>2</jats:sub>), and sulfuryl chloride (SO<jats:sub>2</jats:sub>Cl<jats:sub>2</jats:sub>). In comparison, the high dose rate (∼10<jats:sup>7</jats:sup> Gy s<jats:sup>−1</jats:sup>) electron beam irradiations formed significantly more degradation products. For both cobalt-60 gamma and electron beam irradiations, the observed degradation products were found to evolve as a function of time post-irradiation via the same reaction pathways, with indication of a solvent regeneration mechanism. These findings are fortuitous for process development, as such a mechanism would be beneficial for process longevity and cost effectiveness.","PeriodicalId":21167,"journal":{"name":"Radiochimica Acta","volume":null,"pages":null},"PeriodicalIF":1.8,"publicationDate":"2024-06-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141503021","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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Radiochimica Acta
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