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:536
Name:Benzene, 1-ethyl-2,3-dimethyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H14/c1-4-10-7-5-6-8(2)9(10)3/h5-7H,4H2,1-3H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
335

experimental value

334.47

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

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