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:524
Name:Benzene, 1-chloro-2-methyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
316

experimental value

327.12

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

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