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:363
Name:1,3-Propanediol, 2-methyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C4H10O2/c1-4(2-5)3-6/h4-6H,2-3H2,1H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
13.5

experimental value

15.51

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

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