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

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

InChI
InChI=1S/C21H29FO4/c1-2-3-4-5-10-15-25-20(23)16-11-6-7-12-17(16)21(24)26-19-14-9-8-13-18(19)22/h8-9,13-14,16-17H,2-7,10-12,15H2,1H3
InChI Key
QIUIWYFKVQTRBT-UHFFFAOYSA-N
Formula
C21H29FO4
SMILES
CCCCCCCOC(=O)C1CCCCC1C(=O)Oc1ccccc1F
Molecular Weight1
364.46
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Physical Properties

Property Value Unit Source
ΔfusH° 48.52 kJ/mol Joback Calculated Property
log10WS -5.62 Relay (1.0) Calculated Property
logPoct/wat 5.051 Crippen Calculated Property
McVol 288.780 ml/mol McGowan Calculated Property
Pc 1293.00 kPa Joback Calculated Property
Inp [2513.00; 2513.00]   Show Hide
Inp 2513.00 NIST
Inp 2513.00 NIST
Tboil 641.12 K Relay (1.0) Calculated Property
Tfus 320.93 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [929.87; 1010.98] J/mol×K [842.33; 1050.36] Show Hide
Cp,gas 929.87 J/mol×K 842.33 Joback Calculated Property
Cp,gas 947.14 J/mol×K 877.00 Joback Calculated Property
Cp,gas 962.88 J/mol×K 911.67 Joback Calculated Property
Cp,gas 977.10 J/mol×K 946.34 Joback Calculated Property
Cp,gas 989.84 J/mol×K 981.01 Joback Calculated Property
Cp,gas 1001.12 J/mol×K 1015.69 Joback Calculated Property
Cp,gas 1010.98 J/mol×K 1050.36 Joback Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl decyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl hexyl 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, 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 heptyl ester.

Sources

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