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:617
Name:Bicyclo(3.1.1)heptane, 6,6-dimethyl-2-methylene
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
308

experimental value

329.43

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