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:387
Name:Butanoic acid, 3-methyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
9.8

experimental value

11.11

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

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