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
ΔfusH° 36.76 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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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [295.54; 664.87] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A1.06920e+01
Coefficient B1.21854e+00
Coefficient C-6.70560e-04
Coefficient D1.06200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 295.54 J/mol×K 273.00 Calculated Property
Cp,gas 362.56 J/mol×K 353.78 Calculated Property
Cp,gas 422.30 J/mol×K 434.56 Calculated Property
Cp,gas 475.10 J/mol×K 515.33 Calculated Property
Cp,gas 521.29 J/mol×K 596.11 Calculated Property
Cp,gas 561.21 J/mol×K 676.89 Calculated Property
Cp,gas 595.19 J/mol×K 757.67 Calculated Property
Cp,gas 623.57 J/mol×K 838.44 Calculated Property
Cp,gas 646.69 J/mol×K 919.22 Calculated Property
Cp,gas 664.87 J/mol×K 1000.00 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 hept-2-yl ester. Fumaric acid, naphth-2-yl dec-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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