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:1050
Name:Propane, 1,1'-oxybis[2-methyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H18O/c1-7(2)5-9-6-8(3)4/h7-8H,5-6H2,1-4H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
285

experimental value

296.49

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

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