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:232
Name:Benzene, 1-ethenyl-4-(1-methylethenyl)-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C11H12/c1-4-10-5-7-11(8-6-10)9(2)3/h4-8H,1-2H2,3H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
6.5

experimental value

5.86

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