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:70
Name:1,4-Hexadiene
Description:
Labels:
CAS:
InChi Code:InChI=1S/C6H10/c1-3-5-6-4-2/h3-4,6H,1,5H2,2H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
251

experimental value

276.35

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