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

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

InChI
InChI=1S/C15H20F8O4/c1-9(2)7-26-10(24)5-3-4-6-11(25)27-8-13(18,19)15(22,23)14(20,21)12(16)17/h9,12H,3-8H2,1-2H3
InChI Key
RYFSWGLANMYMMC-UHFFFAOYSA-N
Formula
C15H20F8O4
SMILES
CC(C)COC(=O)CCCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
Molecular Weight1
416.30
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Physical Properties

Property Value Unit Source
ΔfH°gas -2553.31 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 38.70 kJ/mol Joback Calculated Property
ΔvapH° 81.03 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.460 Crippen Calculated Property
McVol 251.250 ml/mol McGowan Calculated Property
Pc 1160.87 kPa Joback Calculated Property
Inp [1631.00; 1631.00]   Show Hide
Inp 1631.00 NIST
Inp 1631.00 NIST
Tboil 548.37 K Relay (1.0) Calculated Property
Tc 681.84 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 [416.94; 871.46] 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 A1.20160e+01
Coefficient B1.80284e+00
Coefficient C-1.25600e-03
Coefficient D3.12600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 416.94 J/mol×K 273.00 Calculated Property
Cp,gas 506.46 J/mol×K 353.78 Calculated Property
Cp,gas 583.92 J/mol×K 434.56 Calculated Property
Cp,gas 650.31 J/mol×K 515.33 Calculated Property
Cp,gas 706.61 J/mol×K 596.11 Calculated Property
Cp,gas 753.81 J/mol×K 676.89 Calculated Property
Cp,gas 792.91 J/mol×K 757.67 Calculated Property
Cp,gas 824.89 J/mol×K 838.44 Calculated Property
Cp,gas 850.75 J/mol×K 919.22 Calculated Property
Cp,gas 871.46 J/mol×K 1000.00 Calculated Property

Similar Compounds

Sebacic acid, isobutyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Glutaric acid, isobutyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, butyl 2,2,3,3,4,4,5,5-octafluoropentyl 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. Adipic acid, heptyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester. Adipic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester. Adipic acid, hexadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Adipic acid, octyl 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, octadecyl 2,2,3,3,4,4,5,5-octafluoropentyl 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, nonyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

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

Sources

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