QSPR ANALYSIS OF TEMPERATURE RELATED AQUEOUS SOLUBILITY OF ORGANIC COMPOUNDS
2D-QSPR models were developed in order to predict aqueous solubility of organic compounds at different temperatures. Impact of various structure features was analyzed and benzene residues contribution to solubility was defined. A reliable model which allows to assess temperature influence on forming...
Main Authors: | , , , , |
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Format: | Article |
Language: | English |
Published: |
Odessa I. I. Mechnikov National University
2014-12-01
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Series: | Vìsnik Odesʹkogo Nacìonalʹnogo Unìversitetu: Hìmìâ |
Subjects: | |
Online Access: | http://heraldchem.onu.edu.ua/article/view/31983 |