Wen, Y.; Su, L. M.; Qin, W. C.; Fu, L.; He, J.; Zhao, Y. H. Linear and non-linear relationships between soil sorption and hydrophobicity: Model, validation and influencing factors. Chemosphere 2012, 86, 634–640.
Compound
| ID: | 246 | |
|---|---|---|
| Name: | 2,2',3,3',4,4'-Hexachlorobiphenyl | |
| Description: | ||
| Labels: | training, Biphenyls | |
| CAS: | 38380-07-3 | |
| InChi Code: | InChI=1S/C12H4Cl6/c13-7-3-1-5(9(15)11(7)17)6-2-4-8(14)12(18)10(6)16/h1-4H |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 5.7 |
experimental value |
| 5.36 |
Eq1: Linear correlation with logP (Training set) |
| 5.47 |
Eq2: Non-linear regression model (Training set) |
| 5.47 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID50858932 | US EPA CompTox Dashboard |