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

Fumaric acid, 2-pentyl 2-fluorophenyl ester

InChI
InChI=1S/C15H17FO4/c1-3-6-11(2)19-14(17)9-10-15(18)20-13-8-5-4-7-12(13)16/h4-5,7-11H,3,6H2,1-2H3/b10-9+
InChI Key
WEKBUCGGTOVYJT-MDZDMXLPSA-N
Formula
C15H17FO4
SMILES
CCCC(C)OC(=O)/C=C/C(=O)Oc1ccccc1F
Molecular Weight1
280.29
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Physical Properties

Property Value Unit Source
Δfus 33.59 kJ/mol Joback Calculated Property
logPoct/wat 3.019 Crippen Calculated Property
McVol 210.800 ml/mol McGowan Calculated Property
Inp [1861.00; 1861.00]   Show Hide
Inp 1861.00 NIST
Inp 1861.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [578.05; 648.02] J/mol×K [729.83; 935.84] Show Hide
Cp,gas 578.05 J/mol×K 729.83 Joback Calculated Property
Cp,gas 591.92 J/mol×K 764.17 Joback Calculated Property
Cp,gas 604.88 J/mol×K 798.50 Joback Calculated Property
Cp,gas 616.95 J/mol×K 832.84 Joback Calculated Property
Cp,gas 628.15 J/mol×K 867.17 Joback Calculated Property
Cp,gas 638.50 J/mol×K 901.51 Joback Calculated Property
Cp,gas 648.02 J/mol×K 935.84 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-octyl 2-fluorophenyl ester. Fumaric acid, 2-pentyl 3-chlorophenyl ester. Fumaric acid, 2-pentyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 4-chlorophenyl hept-2-yl ester. Fumaric acid, 2-octyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 4-octyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2-octyl 3-chlorophenyl ester. Fumaric acid, 4-methoxyphenyl hept-2-yl ester. Fumaric acid, 2-ethylbutyl 2-fluorophenyl ester. Fumaric acid, 2-chlorophenyl hept-2-yl ester. Fumaric acid, naphth-2-yl dec-2-yl ester. Fumaric acid, naphth-2-yl hept-2-yl ester. Fumaric acid, 3-methylbutyl 2-fluorophenyl ester. Fumaric acid, 4-bromophenyl hept-2-yl ester. Fumaric acid, 2-methylpentyl 2-fluorophenyl ester.

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

Sources

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