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:485
Name:1-(1,1-Dimethylethoxy)-2-methyl-propane
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H18O/c1-7(2)6-9-8(3,4)5/h7H,6H2,1-5H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
7.06

experimental value

7.37

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