10967/197 - QDB Compounds

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Gharagheizi, F. Prediction of upper flammability limit percent of pure compounds from their molecular structures. J. Hazard. Mater. 2009, 167, 507–510.

Compound

ID:811
Name:2-Propenoic acid, 2-methyl-, 1,1-dimethylethyl ester
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H14O2/c1-6(2)7(9)10-8(3,4)5/h1H2,2-5H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
7.36

experimental value

8.43

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

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