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:955
Name:Octane, 2,3-dimethyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H22/c1-5-6-7-8-10(4)9(2)3/h9-10H,5-8H2,1-4H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
310

experimental value

301.56

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