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:51
Name:1,3-Isobenzofurandione
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H4O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4H

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
422

experimental value

401.34

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

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