10967/197 - QDB Compounds

QsarDB Repository

Gharagheizi, F. Prediction of upper flammability limit percent of pure compounds from their molecular structures. J. Hazard. Mater. 2009, 167, 507–510.

Compound

ID:639
Name:2-Pentene, 3-methyl-,(E)-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C6H12/c1-4-6(3)5-2/h4H,5H2,1-3H3/b6-4+

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
8.6

experimental value

9.39

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