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:880
Name:Hexanoic acid, 2-hydroxy-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C6H12O3/c1-2-3-4-5(7)6(8)9/h5,7H,2-4H2,1H3,(H,8,9)

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
414

experimental value

424.75

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