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: | 55 | |
|---|---|---|
| Name: | 2,2',5,5'-Tetrabromobiphenyl | |
| Description: | ||
| Labels: | ||
| CAS: | 59080-37-4 | |
| InChi Code: | InChI=1S/C12H6Br4/c13-7-1-3-11(15)9(5-7)10-6-8(14)2-4-12(10)16/h1-6H |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -8.06 |
experimental value |
| -7.56 |
Eq.1: General solubility equation (Test set to verify GSE) |