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:788
Name:Butane, 1,1'-thiobis[3-methyl-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C10H22S/c1-9(2)5-7-11-8-6-10(3)4/h9-10H,5-8H2,1-4H3

Properties

UFLP: Upper flammability limit percent [%]

ValueSource or prediction
5.05

experimental value

5.26

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

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