10967/196 - QDB Compounds

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Gharagheizi, F. A QSPR model for estimation of lower flammability limit temperature of pure compounds based on molecular structure. J. Hazard. Mater. 2009, 169, 217–220.

Compound

ID:778
Name:Ethanol, 2-(ethylthio)-
Description:
Labels:
CAS:
InChi Code:InChI=1S/C4H10OS/c1-2-6-4-3-5/h5H,2-4H2,1H3

Properties

LFLT: Lower flammability limit temperature [K]

ValueSource or prediction
348

experimental value

355.67

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

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