4.4 Article

Solubility prediction in octanol: A technical note

Journal

AAPS PHARMSCITECH
Volume 7, Issue 1, Pages -

Publisher

AMER ASSOC PHARMACEUTICAL SCIENTISTS
DOI: 10.1208/pt070126

Keywords

octanol solubility; activity coefficient; solubility parameter

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The purpose of this work was to derive an equation for the rapid estimation of octanol solubilities of organic compounds. Solubilities ranging over 4 orders of magnitude were predicted with an average absolute error of 0.39 logarithmic units using melting point alone. The greatest error in prediction occurred for strongly bonded compounds.

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