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:677
Name:1,2-Dibromopropane
Description:
Labels:
CAS:78-75-1
InChi Code:InChI=1S/C3H6Br2/c1-3(5)2-4/h3H,2H2,1H3

Properties

logSobs: Aqueous solubility as logS [mol/L]

ValueSource or prediction
-2.15

experimental value

-1.77

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