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: | 200 | |
|---|---|---|
| Name: | 3,4-Dinitrobenzoic acid | |
| Description: | ||
| Labels: | training, Organic_acids | |
| CAS: | 528-45-0 | |
| InChi Code: | InChI=1S/C7H4N2O6/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15/h1-3H,(H,10,11) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 1.53 |
experimental value |
| 1.83 |
Eq1: Linear correlation with logP (Training set) |
| 1.86 |
Eq2: Non-linear regression model (Training set) |
| 1.46 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID1060180 | US EPA CompTox Dashboard |