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: | 503 | |
|---|---|---|
| Name: | 2-Methylbutane | |
| Description: | ||
| Labels: | ||
| CAS: | 78-78-4 | |
| InChi Code: | InChI=1S/C5H12/c1-4-5(2)3/h5H,4H2,1-3H3 |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -3.18 |
experimental value |
| -2.71 |
Eq.1: General solubility equation (Test set to verify GSE) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8025468 | US EPA CompTox Dashboard |