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: | 47 | |
|---|---|---|
| Name: | 2,2',3,4,4',5'-Hexachlorodiphenyl ether | |
| Description: | ||
| Labels: | ||
| CAS: | 71585-36-9 | |
| InChi Code: | InChI=1S/C12H4Cl6O/c13-5-1-2-9(12(18)11(5)17)19-10-4-7(15)6(14)3-8(10)16/h1-4H |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -8.31 |
experimental value |
| -7.64 |
Eq.1: General solubility equation (Test set to verify GSE) |