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:724
Name:Chlorodibromomethane
Description:
Labels:
CAS:124-48-1
InChi Code:InChI=1S/CHBr2Cl/c2-1(3)4/h1H

Properties

MlogP: Measured octanol/water partition coefficient as logP

ValueSource or prediction
2.24

experimental value

logSobs: Aqueous solubility as logS [mol/L]

ValueSource or prediction
-1.9

experimental value

-1.73

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

Links to External Resources