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:474
Name:Benzene, 1-methyl-3-(1-methylethoxy)
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H14O/c1-8(2)11-10-6-4-5-9(3)7-10/h4-8H,1-3H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
7.52

experimental value

7.13

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