Chemical Properties of Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentyl ester

Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentyl ester

InChI
InChI=1S/C14H16F8O4/c1-2-3-4-7-25-9(23)5-6-10(24)26-8-12(17,18)14(21,22)13(19,20)11(15)16/h5-6,11H,2-4,7-8H2,1H3/b6-5+
InChI Key
RRRZLVOBFDUMRO-AATRIKPKSA-N
Formula
C14H16F8O4
SMILES
CCCCCOC(=O)C=CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
Molecular Weight1
400.26
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Physical Properties

Property Value Unit Source
ΔfH°gas -2424.42 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 39.83 kJ/mol Joback Calculated Property
ΔvapH° 80.21 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.990 Crippen Calculated Property
McVol 232.860 ml/mol McGowan Calculated Property
Inp [1578.00; 1578.00]   Show Hide
Inp 1578.00 NIST
Inp 1578.00 NIST
Tboil 534.70 K Relay (1.0) Calculated Property
Tfus 289.56 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [382.04; 788.74] 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 A4.25000e-01
Coefficient B1.72192e+00
Coefficient C-1.28220e-03
Coefficient D3.48600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 382.04 J/mol×K 273.00 Calculated Property
Cp,gas 464.56 J/mol×K 353.78 Calculated Property
Cp,gas 535.17 J/mol×K 434.56 Calculated Property
Cp,gas 594.98 J/mol×K 515.33 Calculated Property
Cp,gas 645.10 J/mol×K 596.11 Calculated Property
Cp,gas 686.61 J/mol×K 676.89 Calculated Property
Cp,gas 720.63 J/mol×K 757.67 Calculated Property
Cp,gas 748.26 J/mol×K 838.44 Calculated Property
Cp,gas 770.60 J/mol×K 919.22 Calculated Property
Cp,gas 788.74 J/mol×K 1000.00 Calculated Property

Similar Compounds

Fumaric acid, hexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, eicosyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl undecyl ester. Fumaric acid, heptadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, nonadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, nonyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, hexadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester. Fumaric acid, octadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl tridecyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester. Fumaric acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl octyl ester. Fumaric acid, dodecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Find more compounds similar to Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentyl ester.

Sources

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