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:801
Name:ethanone, 1-phenyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
348

experimental value

337.77

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

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