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 language | English (US) |
|---|---|
| Pages (from-to) | 775-782 |
| Number of pages | 8 |
| Journal | Chemosphere |
| Volume | 35 |
| Issue number | 4 |
| DOIs | |
| State | Published - Aug 1997 |
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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 journal › Article
}
TY - JOUR
T1 - A comparison of AQUAFAC group q-values to their corresponding CLOGP f-values
AU - Lee, Yung Chi
AU - Pinsuwan, Sirirat
AU - Yalkowsky, Samuel H
PY - 1997/8
Y1 - 1997/8
N2 - 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.
AB - 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.
UR - http://www.scopus.com/inward/record.url?scp=0030759733&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=0030759733&partnerID=8YFLogxK
U2 - 10.1016/S0045-6535(97)00198-7
DO - 10.1016/S0045-6535(97)00198-7
M3 - Article
AN - SCOPUS:0030759733
VL - 35
SP - 775
EP - 782
JO - Chemosphere
JF - Chemosphere
SN - 0045-6535
IS - 4
ER -