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:597
Name:Benzene, 1-chloro-4-(trifluoromethyl)-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C7H4ClF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
10.7

experimental value

9.6

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

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