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: | 47 | |
|---|---|---|
| Name: | Hexachlorocyclopentadiene | |
| Description: | ||
| Labels: | training, Halogenated_cyclic_compounds | |
| CAS: | 77-47-4 | |
| InChi Code: | InChI=1S/C5Cl6/c6-1-2(7)4(9)5(10,11)3(1)8 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 3.2 |
experimental value |
| 4.05 |
Eq1: Linear correlation with logP (Training set) |
| 4.07 |
Eq2: Non-linear regression model (Training set) |
| 4.07 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2020688 | US EPA CompTox Dashboard |