10967/196 - QDB Compounds

QsarDB Repository

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:642
Name:Butane, 2-ethoxy-2-methyl
Description:
Labels:
CAS:
InChi Code:InChI=1S/C7H16O/c1-5-7(3,4)8-6-2/h5-6H2,1-4H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
268

experimental value

269.88

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