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: | 647 | |
|---|---|---|
| Name: | Auramine | |
| Description: | ||
| Labels: | validation, Other_compounds | |
| CAS: | 492-80-8 | |
| InChi Code: | InChI=1S/C17H21N3/c1-19(2)15-9-5-13(6-10-15)17(18)14-7-11-16(12-8-14)20(3)4/h5-12,18H,1-4H3 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 3.31 |
experimental value |
| 2.83 |
Eq1: Linear correlation with logP (Validation set) |
| 2.72 |
Eq2: Non-linear regression model (Validation set) |
| 2.72 |
Eq3: Non-linear regression model with correction factors (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7043821 | US EPA CompTox Dashboard |