10967/188 - QDB Compounds

QsarDB Repository

Ran, Y.; He, Y.; Yang, G.; Johnson, J. L. H.; Yalkowsky, S. H. Estimation of aqueous solubility of organic compounds by using the general solubility equation. Chemosphere 2002, 48, 487–509.

Compound

ID:682
Name:2,6-Dichlorobenzyl alcohol
Description:
Labels:
CAS:15258-73-8
InChi Code:InChI=1S/C7H6Cl2O/c8-6-2-1-3-7(9)5(6)4-10/h1-3,10H,4H2

Properties

logSobs: Aqueous solubility as logS [mol/L]

ValueSource or prediction
-2.1

experimental value

-2.01

Eq.1: General solubility equation (Test set to verify GSE)