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:534
Name:Benzene, 1-ethyl-, 2,4-dimethyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H14/c1-4-10-6-5-8(2)7-9(10)3/h5-7H,4H2,1-3H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
330

experimental value

333.24

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