10967/196 - QDB Compounds

QsarDB Repository

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:236
Name:2-Butanol, 2-methyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C5H12O/c1-4-5(2,3)6/h6H,4H2,1-3H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
293.15

experimental value

282.1

Eq.1: Model for diverse and pure compounds (Validation set)

Links to External Resources