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: | 250 | |
|---|---|---|
| Name: | 2,2',3,4,5,5',6-Heptachlorobiphenyl | |
| Description: | ||
| Labels: | training, Biphenyls | |
| CAS: | 52712-05-7 | |
| InChi Code: | InChI=1S/C12H3Cl7/c13-4-1-2-6(14)5(3-4)7-8(15)10(17)12(19)11(18)9(7)16/h1-3H |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 5.95 |
experimental value |
| 5.31 |
Eq1: Linear correlation with logP (Training set) |
| 5.44 |
Eq2: Non-linear regression model (Training set) |
| 5.44 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID1074175 | US EPA CompTox Dashboard |