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:959
Name:Octane, 2,7-dimethyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H22/c1-9(2)7-5-6-8-10(3)4/h9-10H,5-8H2,1-4H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
307

experimental value

308.95

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

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