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:207
Name:2-Ethyl-1,3-dimethyl benzene
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H14/c1-4-10-8(2)6-5-7-9(10)3/h5-7H,4H2,1-3H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
6.4

experimental value

6.09

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