Development of Abraham model correlations for dimethyl adipate from measured solubility data of nonelectrolyte organic compounds

IF 16.4 1区化学 Q1 CHEMISTRY, MULTIDISCIPLINARY

Accounts of Chemical Research Pub Date : 2023-06-17 DOI:10.1080/00319104.2023.2225206

Nikita Shanmugam, Amy Zhou, Ramya Motati, Emily Yao, Trisha Kandi, Laine Longacre, Darla Benavides, Saikiran Motati, W. Acree

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引用次数: 5

Abstract

ABSTRACT Mole fraction solubilities are reported for acenaphthene, o-acetoacetanisidide, anthracene, benzil, benzoic acid, benzoin, 4-tert-butylbenzoic acid, 1-chloroanthraquinone, 4-chlorobenzoic acid, 2-chloro-5-nitrobenzoic acid, 4-chloro-3-nitrobenzoic acid, 3,4-dichlorobenzoic acid, 3,4-dimethoxybenzoic acid, 3,5-dinitrobenzoic acid, diphenyl sulphone, 2-ethylanthraquinone, 2-naphthoxyacetic acid, 2-hydroxybenzoic acid, N-hydroxyphthalimide, 2-methoxybenzoic acid, 4-methoxybenzoic acid, 3-methylbenzoic acid, 2-methyl-3-nitrobenzoic acid, 3-methyl-4-nitrobenzoic acid, 4-methyl-3-nitrobenzoic acid, 3-nitrobenzoic acid, 4-nitrobenzoic acid, salicylamide, 3,4,5-trimethoxybenzoic acid, trans-stilbene, thioxanthen-9-one and xanthene dissolved in dimethyl adipate at 298.15 K. Results of these measurements, combined with published literature data for adipic acid, glutaric acid and succinic acid, are used to derive predictive Abraham model correlations. The derived correlations back-calculate the observed solubility data to within ±0.12 log units.

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从非电解质有机化合物的溶解度数据建立己二酸二甲酯的亚伯拉罕模型相关性

摘要报道了苊、邻乙酰乙酰苯甲酸、蒽、苯、苯甲酸、苯甲酸、4-叔丁基苯甲酸、1-氯蒽醌、4-氯苯甲酸、2-氯-5-硝基苯甲酸、4-氯-3-硝基苯甲酸、3,4-二氯苯甲酸、3,4-二甲氧基苯甲酸、3,5-二硝基苯甲酸、二苯基砜、2-乙基蒽醌、2-萘氧乙酸、2-羟基苯甲酸、n -羟基邻苯亚胺、2-甲氧基苯甲酸、4-甲氧基苯甲酸、3-甲基苯甲酸、2-甲基-3-硝基苯甲酸、3-甲基-4-硝基苯甲酸、4-甲基-3-硝基苯甲酸、4-硝基苯甲酸、水杨胺、3,4,5-三甲氧基苯甲酸、反式二苯乙烯、硫氧杂蒽-9-酮和杂蒽在298.15 K下溶解于己二酸二甲酯中。这些测量结果，结合已发表的己二酸、戊二酸和琥珀酸的文献数据，用于推导预测的亚伯拉罕模型相关性。推导出的相关性反演了观测到的溶解度数据，误差在±0.12个对数单位内。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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来源期刊

Accounts of Chemical Research 化学-化学综合

CiteScore

31.40

自引率

1.10%

发文量

312

审稿时长

2 months

期刊介绍： Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance. Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.