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: | 554 | |
|---|---|---|
| Name: | Ethane-1,2-diyldicarbamodithioic acid | |
| Description: | ||
| Labels: | training, Organic_sulfides | |
| CAS: | 111-54-6 | |
| InChi Code: | InChI=1S/C4H8N2S4/c7-3(8)5-1-2-6-4(9)10/h1-2H2,(H2,5,7,8)(H2,6,9,10) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.74 |
experimental value |
| 1.19 |
Eq1: Linear correlation with logP (Training set) |
| 1.44 |
Eq2: Non-linear regression model (Training set) |
| 1.44 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID5043972 | US EPA CompTox Dashboard |