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: | 1085 | |
|---|---|---|
| Name: | Propanoic acid, 2-(2-hydroxy-1-oxopropoxy)-1-carboxyethyl e | |
| Description: | ||
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C9H14O7/c1-4(7(11)12)6(8(13)14)3-16-9(15)5(2)10/h4-6,10H,3H2,1-2H3,(H,11,12)(H,13,14) |
Properties
LFLT: Lower flammability limit temperature [K]
| Value | Source or prediction |
|---|---|
| 494 |
experimental value |
| 511.81 |
Eq.1: Model for diverse and pure compounds (Training set) |