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:893
Name:Isoprene
Description:
Labels:
CAS:
InChi Code:InChI=1S/C5H8/c1-4-5(2)3/h4H,1-2H2,3H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
227

experimental value

236.93

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

Links to External Resources