Ran, Y.; He, Y.; Yang, G.; Johnson, J. L. H.; Yalkowsky, S. H. Estimation of aqueous solubility of organic compounds by using the general solubility equation. Chemosphere 2002, 48, 487–509.
Compound
| ID: | 985 | |
|---|---|---|
| Name: | Trans-crotonaldehyde | |
| Description: | ||
| Labels: | ||
| CAS: | 123-73-9 | |
| InChi Code: | InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2+ |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| 0.32 |
experimental value |
| -0.02 |
Eq.1: General solubility equation (Test set to verify GSE) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID6020351 | US EPA CompTox Dashboard |