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: | 472 | |
|---|---|---|
| Name: | Atratone | |
| Description: | ||
| Labels: | training, Symtriazines | |
| CAS: | 1610-17-9 | |
| InChi Code: | InChI=1S/C9H17N5O/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.64 |
experimental value |
| 2.36 |
Eq1: Linear correlation with logP (Training set) |
| 2.29 |
Eq2: Non-linear regression model (Training set) |
| 2.29 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0037493 | US EPA CompTox Dashboard |