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:62
Name:1,4-Benzenedicarboxylic acid, bis(2-hydroxyethyl) ester
Description:
Labels:
CAS:
InChi Code:InChI=1S/C12H14O6/c13-5-7-17-11(15)9-1-2-10(4-3-9)12(16)18-8-6-14/h1-4,13-14H,5-8H2

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
544

experimental value

560.19

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

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