二甲硝唑在三种二元溶剂体系中的溶解度测定及相关性研究

IF 2 3区 工程技术 Q3 CHEMISTRY, MULTIDISCIPLINARY
Yunfan Yang, Yuze Xie, Qinghu Zhang, Yang Zhang* and Jian Zhou*, 
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引用次数: 0

摘要

在297.95 ~ 323.15 K的常压条件下,用重量法测定了二甲硝唑(DMZ)在甲醇+水、乙醇+水和异丙醇+水等不同二元溶剂混合物中的溶解度。实验数据表明,DMZ在三种溶剂体系中的溶解度均随温度升高而增大。在恒温条件下,随着乙醇和异丙醇摩尔分数的增加,二甲硝唑在乙醇+水和异丙醇+水体系中的溶解度先升高后降低,在乙醇和异丙醇摩尔分数分别为0.6003和0.4999时达到最大值。然而,在甲醇+水体系中,溶解度随着甲醇摩尔分数的增加而不断增加,尽管速率逐渐减小。采用改进的Apelblat模型、通用共溶解度模型、Apelblat - jouyban - acree模型、van 't Hoff-Jouyban-Acree模型和NRTL模型对三种二元溶剂混合物中DMZ的溶解度数据进行了拟合,拟合结果良好,可用于溶解度预测。此外,使用KAT-LSER分析评估了溶剂-溶剂和溶剂-溶质相互作用。结果表明,氢键碱度和溶剂酸度是影响溶解度的主要因素。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Measurement and Correlation of the Solubility of Dimetridazole in Three Binary Solvent Systems

Measurement and Correlation of the Solubility of Dimetridazole in Three Binary Solvent Systems

The solubilities of dimetridazole (DMZ) in different binary solvent mixtures─methanol + water, ethanol + water, and isopropanol + water─were measured by using the gravimetric method under atmospheric pressure, within the temperature range of 297.95–323.15 K. The experimental data indicate that the solubilities of DMZ in all three solvent systems increased with rising temperature. At a constant temperature, the solubilities of dimetridazole in the ethanol + water and isopropanol + water systems initially increased and then decreased with the increasing mole fraction of ethanol or isopropanol, reaching maximum values at mole fractions of 0.6003 for ethanol and 0.4999 for isopropanol. However, in the methanol + water system, the solubility increased continuously with an increased mole fraction of methanol, albeit at a gradually diminishing rate. The solubility data for DMZ in the three binary solvent mixtures were successfully correlated using the modified Apelblat, the general cosolvency model, the Apelblat–Jouyban–Acree, the van’t Hoff–Jouyban–Acree, and the NRTL models, all models provided good fitting results and can be used for solubility prediction. Furthermore, solvent–solvent and solvent–solute interactions were evaluated using the KAT-LSER analysis. The results indicate that the hydrogen bond basicity and acidity of the solvent are the main factors influencing solubility.

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来源期刊
Journal of Chemical & Engineering Data
Journal of Chemical & Engineering Data 工程技术-工程:化工
CiteScore
5.20
自引率
19.20%
发文量
324
审稿时长
2.2 months
期刊介绍: The Journal of Chemical & Engineering Data is a monthly journal devoted to the publication of data obtained from both experiment and computation, which are viewed as complementary. It is the only American Chemical Society journal primarily concerned with articles containing data on the phase behavior and the physical, thermodynamic, and transport properties of well-defined materials, including complex mixtures of known compositions. While environmental and biological samples are of interest, their compositions must be known and reproducible. As a result, adsorption on natural product materials does not generally fit within the scope of Journal of Chemical & Engineering Data.
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