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:189
Name:Benzene, heptyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C13H20/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5,7,10H2,1H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
5.1

experimental value

5.47

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

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