Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl hexyl ester

1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl hexyl ester

InChI
InChI=1S/C20H27FO4/c1-2-3-4-9-14-24-19(22)15-10-5-6-11-16(15)20(23)25-18-13-8-7-12-17(18)21/h7-8,12-13,15-16H,2-6,9-11,14H2,1H3
InChI Key
RMTXPYILJQATQJ-UHFFFAOYSA-N
Formula
C20H27FO4
SMILES
CCCCCCOC(=O)C1CCCCC1C(=O)Oc1ccccc1F
Molecular Weight1
350.42
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Physical Properties

Property Value Unit Source
ΔfusH° 45.93 kJ/mol Joback Calculated Property
log10WS -5.29 Relay (1.0) Calculated Property
logPoct/wat 4.661 Crippen Calculated Property
McVol 274.690 ml/mol McGowan Calculated Property
Pc 1387.11 kPa Joback Calculated Property
Inp [2410.00; 2410.00]   Show Hide
Inp 2410.00 NIST
Inp 2410.00 NIST
Tboil 633.17 K Relay (1.0) Calculated Property
Tfus 318.35 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [380.07; 944.61] 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 A-3.76550e+01
Coefficient B1.76322e+00
Coefficient C-8.81160e-04
Coefficient D1.00200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 380.07 J/mol×K 273.00 Calculated Property
Cp,gas 480.28 J/mol×K 353.78 Calculated Property
Cp,gas 570.39 J/mol×K 434.56 Calculated Property
Cp,gas 650.70 J/mol×K 515.33 Calculated Property
Cp,gas 721.53 J/mol×K 596.11 Calculated Property
Cp,gas 783.20 J/mol×K 676.89 Calculated Property
Cp,gas 836.02 J/mol×K 757.67 Calculated Property
Cp,gas 880.32 J/mol×K 838.44 Calculated Property
Cp,gas 916.41 J/mol×K 919.22 Calculated Property
Cp,gas 944.61 J/mol×K 1000.00 Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl decyl ester. 1,2-Cyclohexanedicarboxylic acid, dodecyl 2-fluorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl undecyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl heptyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 2-fluorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl isohexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl propyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-fluorophenyl nonyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-fluorophenyl hexyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-fluorophenyl octyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-fluorophenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl isobutyl ester. 1,2-Cyclohexanedicarboxylic acid, ethyl 2-fluorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-fluorophenyl isobutyl ester.

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl hexyl ester.

Sources

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