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: | 8 | |
|---|---|---|
| Name: | 2,2',3,3',4,4',5,5',6'-Nonachlorodiphenyl ether | |
| Description: | ||
| Labels: | ||
| CAS: | 83992-73-8 | |
| InChi Code: | InChI=1S/C12HCl9O/c13-2-1-3(5(15)6(16)4(2)14)22-12-10(20)8(18)7(17)9(19)11(12)21/h1H |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -10.55 |
experimental value |
| -11.09 |
Eq.1: General solubility equation (Test set to verify GSE) |