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: | 687 | |
|---|---|---|
| Name: | Triforine | |
| Description: | ||
| Labels: | validation, Other_compounds | |
| CAS: | 26644-46-2 | |
| InChi Code: | InChI=1S/C10H14Cl6N4O2/c11-9(12,13)7(17-5-21)19-1-2-20(4-3-19)8(18-6-22)10(14,15)16/h5-8H,1-4H2,(H,17,21)(H,18,22) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.3 |
experimental value |
| 1.9 |
Eq1: Linear correlation with logP (Validation set) |
| 1.91 |
Eq2: Non-linear regression model (Validation set) |
| 1.91 |
Eq3: Non-linear regression model with correction factors (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID5032654 | US EPA CompTox Dashboard |