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:25
Name:Hexane, 2,2,5-trimethyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C9H20/c1-8(2)6-7-9(3,4)5/h8H,6-7H2,1-5H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
5.2

experimental value

4.51

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

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