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:622
Name:Octane, 2,3-dimethyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H22/c1-5-6-7-8-10(4)9(2)3/h9-10H,5-8H2,1-4H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
5.1

experimental value

5.31

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