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: | 395 | |
|---|---|---|
| Name: | 4-Methyl-N-(1,1-dimethyl-2-propynyl)benzamide | |
| Description: | ||
| Labels: | training, Benzamides | |
| CAS: | 39108-91-3 | |
| InChi Code: | InChI=1S/C13H15NO/c1-5-13(3,4)14-12(15)11-8-6-10(2)7-9-11/h1,6-9H,2-4H3,(H,14,15) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 1.76 |
experimental value |
| 2.25 |
Eq1: Linear correlation with logP (Training set) |
| 2.19 |
Eq2: Non-linear regression model (Training set) |
| 2.19 |
Eq3: Non-linear regression model with correction factors (Training set) |