USE OF LINEAR FREE-ENERGY RELATIONSHIPS IN TOXICOLOGY - PREDICTION OF PARTITION-COEFFICIENTS OF VOLATILE LIPOPHILIC COMPOUNDS

被引：4

作者：

CSANADY, GA ^{[1
]}

LAIB, RJ ^{[1
]}

机构：

[1] UNIV DORTMUND,INST ARBEITSPHYSIOL,W-4600 DORTMUND,GERMANY

来源：

ARCHIVES OF TOXICOLOGY | 1990年 / 64卷 / 07期

关键词：

Lipophilic; volatile compounds; Partition coefficient; Quantitative Structure Activity Relationship (QSAR);

D O I：

10.1007/BF01971841

中图分类号：

R99 [毒物学（毒理学）];

学科分类号：

100405 ;

摘要：

A relationship between the partition coefficient (P) and the boiling point (TBp, expressed in degrees Kelvin) was derived as {Mathematical expression}. The relationship is based on the Clausius-Clapeyron equation and is valid for volatile lipophilic compounds, when one of the phases is air. Specific tissue/air and whole animal/air partition coefficients, as published in the literature, were used to validate the equation. © 1990 Springer-Verlag.

引用

页码：594 / 596

页数：3

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