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:320
Name:2-Propanol, 1-(2-(methoxy-1-methylethoxy)-1-methylethoxy)-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H22O4/c1-8(11)5-13-10(3)7-14-9(2)6-12-4/h8-11H,5-7H2,1-4H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
393

experimental value

414.32

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