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: | 100 | |
|---|---|---|
| Name: | 2,8-Dichlorodibenzo-p-dioxin | |
| Description: | ||
| Labels: | ||
| CAS: | 38964-22-6 | |
| InChi Code: | InChI=1S/C12H6Cl2O2/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9/h1-6H |
Properties
MlogP: Measured octanol/water partition coefficient as logP
| Value | Source or prediction |
|---|---|
| 6.38 |
experimental value |
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -7.18 |
experimental value |
| -6.62 |
Eq.1: General solubility equation (Test set to verify GSE) |