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:753
Name:1-Octanol, 6-methyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C9H20O/c1-3-9(2)7-5-4-6-8-10/h9-10H,3-8H2,1-2H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
9.07

experimental value

6.92

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