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: | 56 | |
|---|---|---|
| Name: | 1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)- | |
| Description: | ||
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C6H14O3/c1-2-6(3-7,4-8)5-9/h7-9H,2-5H2,1H3 |
Properties
LFLT: Lower flammability limit temperature [K]
| Value | Source or prediction |
|---|---|
| 447 |
experimental value |
| 449.56 |
Eq.1: Model for diverse and pure compounds (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2026448 | US EPA CompTox Dashboard |