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:359
Name:3-Cyclohexene-1-carboxaldehyde
Description:
Labels:
CAS:
InChi Code:InChI=1S/C7H10O/c8-6-7-4-2-1-3-5-7/h1-2,6-7H,3-5H2

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
320.15

experimental value

322.75

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

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