Abraham model solute descriptors reveal strong intramolecular hydrogen bonding in 1,4-dihydroxyanthraquinone and 1,8-dihydroxyanthraquinone

被引：18

作者：

Acree, William E., Jr. ^{[1
]}

Smart, Katherine ^{[1
]}

Abraham, Michael H. ^{[2
]}

机构：

[1] Univ North Texas, Dept Chem, 1155 Union Circle Dr 305070, Denton, TX 76203 USA

[2] UCL, Dept Chem, London, England

来源：

PHYSICS AND CHEMISTRY OF LIQUIDS | 2018年 / 56卷 / 03期

关键词：

14-Dihydroxyanthraquinone; 18-dihydroxyanthraquinone; Abraham model solute descriptors; intramolecular hydrogen bonding; BIPHASIC SYSTEMS; PREDICTION; SOLUBILITY; PARTITION; ACIDITY; PHASE; WATER;

D O I：

10.1080/00319104.2017.1407934

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

Published solubility data is used to calculate the numerical values of the Abraham model solute descriptors for both 1,4-dihydroxyanthraquinone and 1,8-dihydroxyanthraquinone. The calculated value of the A solute descriptor (e.g. A=0) indicates that the two dihydroxyanthraquinones cannot act as hydrogen-bond donors in their interactions with surrounding solvent molecules. Strong intramolecular hydrogen bonding between the hydrogen of the -OH functional groups and the oxygen atom of the neighbouring aromatic carbonyl group is believed to be the reason for the molecules' inability to serve as a hydrogen-bond donor.

引用

页码：416 / 420

页数：5

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