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:1037
Name:Phenol, nonyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
436

experimental value

409.62

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