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:656
Name:Butanedioic acid, diethyl ester
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H14O4/c1-3-11-7(9)5-6-8(10)12-4-2/h3-6H2,1-2H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
10.9

experimental value

9.32

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

Links to External Resources