ID: | 696 | |
---|---|---|
Name: | 2-Octanone | |
Description: | ||
Labels: | ||
CAS: | 111-13-7 | |
InChi Code: | InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3 |
MlogP: Measured octanol/water partition coefficient as logP
Value | Source or prediction |
---|---|
2.37 |
experimental value |
logSobs: Aqueous solubility as logS [mol/L]
Value | Source or prediction |
---|---|
-2.05 |
experimental value |
-1.94 |
Eq.1: General solubility equation (Test set to verify GSE) |
Link | Resource description |
---|---|
DTXSID4021927 | US EPA CompTox Dashboard |