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: | 24 | |
|---|---|---|
| Name: | 2,2',3,3',4,4',5-Heptachlorodiphenyl ether | |
| Description: | ||
| Labels: | ||
| CAS: | 71585-40-5 | |
| InChi Code: | InChI=1S/C12H3Cl7O/c13-4-1-2-6(10(17)8(4)15)20-7-3-5(14)9(16)12(19)11(7)18/h1-3H |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -9.12 |
experimental value |
| -8.58 |
Eq.1: General solubility equation (Test set to verify GSE) |