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:145
Name:1,2-Pentadiene
Description:
Labels:
CAS:
InChi Code:InChI=1S/C5H8/c1-3-5-4-2/h5H,1,4H2,2H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
12.3

experimental value

10.83

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