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:154
Name:1-Octadecanol
Description:
Labels:
CAS:
InChi Code:InChI=1S/C18H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h19H,2-18H2,1H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
450

experimental value

471.32

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

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