Chemical Properties of Adipic acid, isohexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

Adipic acid, isohexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI
InChI=1S/C17H24F8O4/c1-11(2)6-5-9-28-12(26)7-3-4-8-13(27)29-10-15(20,21)17(24,25)16(22,23)14(18)19/h11,14H,3-10H2,1-2H3
InChI Key
HSJFXNBLURQLBE-UHFFFAOYSA-N
Formula
C17H24F8O4
SMILES
CC(C)CCCOC(=O)CCCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
Molecular Weight1
444.36
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Physical Properties

Property Value Unit Source
ΔfH°gas -2591.74 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 43.88 kJ/mol Joback Calculated Property
ΔvapH° 86.55 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 5.240 Crippen Calculated Property
McVol 279.430 ml/mol McGowan Calculated Property
Inp [1819.00; 1819.00]   Show Hide
Inp 1819.00 NIST
Inp 1819.00 NIST
Tboil 572.34 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 [459.37; 974.64] 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 A1.01980e+01
Coefficient B1.99284e+00
Coefficient C-1.36480e-03
Coefficient D3.36400e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 459.37 J/mol×K 273.00 Calculated Property
Cp,gas 559.30 J/mol×K 353.78 Calculated Property
Cp,gas 646.08 J/mol×K 434.56 Calculated Property
Cp,gas 720.77 J/mol×K 515.33 Calculated Property
Cp,gas 784.43 J/mol×K 596.11 Calculated Property
Cp,gas 838.14 J/mol×K 676.89 Calculated Property
Cp,gas 882.95 J/mol×K 757.67 Calculated Property
Cp,gas 919.92 J/mol×K 838.44 Calculated Property
Cp,gas 950.13 J/mol×K 919.22 Calculated Property
Cp,gas 974.64 J/mol×K 1000.00 Calculated Property

Similar Compounds

Sebacic acid, isohexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Glutaric acid, isohexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2-methylpentyl ester. Adipic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentyl ester. Adipic acid, hexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3,7-dimethyloctyl ester. Adipic acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, nonyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, dodecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester. Adipic acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, heptadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tridecyl ester. Adipic acid, octadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, eicosyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Find more compounds similar to Adipic acid, isohexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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