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:340
Name:alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol
Description:
Labels:
CAS:
InChi Code:InChI=1/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
6.45

experimental value

6.8

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

Links to External Resources