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:936
Name:Nonane, 2,2,4,4,6,8,8-heptamethyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C16H34/c1-13(10-14(2,3)4)11-16(8,9)12-15(5,6)7/h13H,10-12H2,1-9H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
363

experimental value

334.67

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

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