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:183
Name:Benzene, 1,4-bis(1,1-dimethylethyl)-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C14H22/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h7-10H,1-6H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
4.6

experimental value

5.24

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

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