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:754
Name:Phenol, 5-methyl-2-(1-methylethyl)-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
6.95

experimental value

6.06

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

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