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:661
Name:Hexane, 1-ethoxy-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H18O/c1-3-5-6-7-8-9-4-2/h3-8H2,1-2H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
7.2

experimental value

8.01

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