Gharagheizi, F. A QSPR model for estimation of lower flammability limit temperature of pure compounds based on molecular structure. J. Hazard. Mater. 2009, 169, 217–220.
Compound
| ID: | 879 | |
|---|---|---|
| Name: | Hexanoic acid, 2-ethyl- | |
| Description: | ||
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C8H16O2/c1-3-5-6-7(4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10) |
Properties
LFLT: Lower flammability limit temperature [K]
| Value | Source or prediction |
|---|---|
| 384 |
experimental value |
| 373.08 |
Eq.1: Model for diverse and pure compounds (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID9025293 | US EPA CompTox Dashboard |