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:391
Name:Propanoic acid, 2,2'-oxybis-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C6H10O5/c1-3(5(7)8)11-4(2)6(9)10/h3-4H,1-2H3,(H,7,8)(H,9,10)

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
11

experimental value

11.52

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