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: | 227 | |
|---|---|---|
| Name: | 2-Butoxy-2-oxoethyl butyl phthalate | |
| Description: | ||
| Labels: | training, Benzoates | |
| CAS: | 85-70-1 | |
| InChi Code: | InChI=1S/C18H24O6/c1-3-5-11-22-16(19)13-24-18(21)15-10-8-7-9-14(15)17(20)23-12-6-4-2/h7-10H,3-6,11-13H2,1-2H3 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 3.7 |
experimental value |
| 3.56 |
Eq1: Linear correlation with logP (Training set) |
| 3.50 |
Eq2: Non-linear regression model (Training set) |
| 3.5 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7023938 | US EPA CompTox Dashboard |