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:134
Name:4-ethyl-4-heptanol
Description:
Labels:Validation
CAS:
InChi Code:InChI=1S/C9H20O/c1-4-7-9(10,6-3)8-5-2/h10H,4-8H2,1-3H3

Properties

FP: Flash point [K]

ValueSource or prediction
177

experimental value

178.28

Tab3Tab4: ANFIS model for alcohols (Validation set)

182.25

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

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