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:917
Name:Naphthalene, 1-decyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C20H28/c1-2-3-4-5-6-7-8-9-13-18-15-12-16-19-14-10-11-17-20(18)19/h10-12,14-17H,2-9,13H2,1H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
458

experimental value

446.26

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

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