10967/160 - QDB Compounds

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Khajeh, A.; Modarress, H. Quantitative Structure–Property Relationship for Flash Points of Alcohols. Ind. Eng. Chem. Res. 2011, 50, 11337-11342.

Compound

ID:122
Name:1-amino-2-propanol
Description:
Labels:Validation
CAS:
InChi Code:InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3

Properties

FP: Flash point [K]

ValueSource or prediction
165

experimental value

163.17

Tab3Tab4: ANFIS model for alcohols (Validation set)

209.72

Eq12: GFA-MLR model for alcohols (Validation set)

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