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:395
Name:5-Isobenzofurancarboxylic acid, 1,3-dihydro-1,3-dioxo-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C9H4O5/c10-7(11)4-1-2-5-6(3-4)9(13)14-8(5)12/h1-3H,(H,10,11)

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
509

experimental value

481.52

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

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