Chemical Properties of Fumaric acid, 2-ethylbutyl 2-fluorophenyl ester

Fumaric acid, 2-ethylbutyl 2-fluorophenyl ester

InChI
InChI=1S/C16H19FO4/c1-3-12(4-2)11-20-15(18)9-10-16(19)21-14-8-6-5-7-13(14)17/h5-10,12H,3-4,11H2,1-2H3/b10-9+
InChI Key
GHVSTNBJCIXJMB-MDZDMXLPSA-N
Formula
C16H19FO4
SMILES
CCC(CC)COC(=O)C=CC(=O)Oc1ccccc1F
Molecular Weight1
294.32
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Physical Properties

Property Value Unit Source
Δfus 36.18 kJ/mol Joback Calculated Property
logPoct/wat 3.267 Crippen Calculated Property
McVol 224.890 ml/mol McGowan Calculated Property
Inp [2009.00; 2009.00]   Show Hide
Inp 2009.00 NIST
Inp 2009.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [632.25; 704.02] J/mol×K [752.71; 956.70] Show Hide
Cp,gas 632.25 J/mol×K 752.71 Joback Calculated Property
Cp,gas 646.49 J/mol×K 786.71 Joback Calculated Property
Cp,gas 659.78 J/mol×K 820.71 Joback Calculated Property
Cp,gas 672.16 J/mol×K 854.71 Joback Calculated Property
Cp,gas 683.64 J/mol×K 888.71 Joback Calculated Property
Cp,gas 694.25 J/mol×K 922.71 Joback Calculated Property
Cp,gas 704.02 J/mol×K 956.70 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-methylpentyl 2-fluorophenyl ester. Fumaric acid, 2-ethylhexyl 2-fluorophenyl ester. Fumaric acid, 2,4,4-trimethylpentyl 2-fluorophenyl ester. Fumaric acid, 3-methylbutyl 2-fluorophenyl ester. Fumaric acid, 2-ethylbutyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2-ethylbutyl 3-chlorophenyl ester. Fumaric acid, 4-methoxyphenyl 2-ethylhexyl ester. Fumaric acid, 2-methylpentyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 4-cyanophenyl 2-ethylhexyl ester. Fumaric acid, 2-ethylhexyl 2-chloro-6-fluorophenyl ester. Fumaric acid, naphth-2-yl 2-ethylhexyl ester. Fumaric acid, 4-bromophenyl 2-ethylhexyl ester. Fumaric acid, 3-chlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-methylpentyl 3-chlorophenyl ester. Fumaric acid, 2-chlorophenyl 2-ethylhexyl ester.

Find more compounds similar to Fumaric acid, 2-ethylbutyl 2-fluorophenyl ester.

Sources

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