A comparison of AQUAFAC group q-values to their corresponding CLOGP f-values

Yung Chi Lee, Sirirat Pinsuwan, Samuel H Yalkowsky

Research output: Contribution to journalArticle

4 Citations (Scopus)

Abstract

Previous studies have shown that AQUAFAC is more accurate than the general solubility equation for the estimation of aqueous solubility. The relationship between AQUAFAC group q-values and their corresponding CLOGP f-values is investigated in this study. The q- and f-values are comparable in magnitude for hydrocarbon and halocarbon groups but not for hydrogen bonding groups.

Original languageEnglish (US)
Pages (from-to)775-782
Number of pages8
JournalChemosphere
Volume35
Issue number4
DOIs
StatePublished - Aug 1997

Fingerprint

Solubility
solubility
Halocarbons
halocarbon
Hydrogen Bonding
Hydrocarbons
Hydrogen bonds
hydrogen
hydrocarbon
comparison

ASJC Scopus subject areas

  • Environmental Science(all)
  • Environmental Chemistry

Cite this

A comparison of AQUAFAC group q-values to their corresponding CLOGP f-values. / Lee, Yung Chi; Pinsuwan, Sirirat; Yalkowsky, Samuel H.

In: Chemosphere, Vol. 35, No. 4, 08.1997, p. 775-782.

Research output: Contribution to journalArticle

Lee, Yung Chi ; Pinsuwan, Sirirat ; Yalkowsky, Samuel H. / A comparison of AQUAFAC group q-values to their corresponding CLOGP f-values. In: Chemosphere. 1997 ; Vol. 35, No. 4. pp. 775-782.
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