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:594
Name:Benzenemethanol, 3-methyl
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H10O/c1-7-3-2-4-8(5-7)6-9/h2-5,9H,6H2,1H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
375

experimental value

389.65

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