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: | 119 | |
|---|---|---|
| Name: | Flumetralin | |
| Description: | ||
| Labels: | training, Nitro-N-alkylanilines | |
| CAS: | 62924-70-3 | |
| InChi Code: | InChI=1S/C16H12ClF4N3O4/c1-2-22(8-10-11(17)4-3-5-12(10)18)15-13(23(25)26)6-9(16(19,20)21)7-14(15)24(27)28/h3-7H,2,8H2,1H3 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 4 |
experimental value |
| 4.77 |
Eq1: Linear correlation with logP (Training set) |
| 4.94 |
Eq2: Non-linear regression model (Training set) |
| 4.94 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7032553 | US EPA CompTox Dashboard |