10967/196 - QDB Compounds

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Gharagheizi, F. A QSPR model for estimation of lower flammability limit temperature of pure compounds based on molecular structure. J. Hazard. Mater. 2009, 169, 217–220.

Compound

ID:233
Name:2-Butenedioic acid (Z)-, diethyl ester
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H12O4/c1-3-11-7(9)5-6-8(10)12-4-2/h5-6H,3-4H2,1-2H3/b6-5-

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
369

experimental value

371.56

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

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