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:877
Name:Hexanenitrile, 6-amino-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C6H12N2/c7-5-3-1-2-4-6-8/h1-5,7H2

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
378

experimental value

348.19

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

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