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: | 249 | |
|---|---|---|
| Name: | 2,2',4,4',5,5'-Hexachlorobiphenyl | |
| Description: | ||
| Labels: | training, Biphenyls | |
| CAS: | 35065-27-1 | |
| InChi Code: | InChI=1S/C12H4Cl6/c13-7-3-11(17)9(15)1-5(7)6-2-10(16)12(18)4-8(6)14/h1-4H |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 5.9 |
experimental value |
| 5.19 |
Eq1: Linear correlation with logP (Training set) |
| 5.35 |
Eq2: Non-linear regression model (Training set) |
| 5.35 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2032180 | US EPA CompTox Dashboard |