Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, heptyl 3-methylphenyl ester

1,2-Cyclohexanedicarboxylic acid, heptyl 3-methylphenyl ester

InChI
InChI=1S/C22H32O4/c1-3-4-5-6-9-15-25-21(23)19-13-7-8-14-20(19)22(24)26-18-12-10-11-17(2)16-18/h10-12,16,19-20H,3-9,13-15H2,1-2H3
InChI Key
HZSSQPISMQKMBH-UHFFFAOYSA-N
Formula
C22H32O4
SMILES
CCCCCCCOC(=O)C1CCCCC1C(=O)Oc1cccc(C)c1
Molecular Weight1
360.49
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Physical Properties

Property Value Unit Source
ΔfusH° 44.87 kJ/mol Joback Calculated Property
IE 8.42 eV Relay (1.0) Calculated Property
logPoct/wat 5.220 Crippen Calculated Property
McVol 301.100 ml/mol McGowan Calculated Property
Inp [2623.00; 2623.00]   Show Hide
Inp 2623.00 NIST
Inp 2623.00 NIST
Tboil 662.46 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [996.81; 1076.30] J/mol×K [901.88; 1119.41] Show Hide
Cp,gas 996.81 J/mol×K 901.88 Joback Calculated Property
Cp,gas 1013.95 J/mol×K 938.13 Joback Calculated Property
Cp,gas 1029.50 J/mol×K 974.39 Joback Calculated Property
Cp,gas 1043.48 J/mol×K 1010.64 Joback Calculated Property
Cp,gas 1055.92 J/mol×K 1046.90 Joback Calculated Property
Cp,gas 1066.85 J/mol×K 1083.15 Joback Calculated Property
Cp,gas 1076.30 J/mol×K 1119.41 Joback Calculated Property
η [0.0000559; 0.0006041] Pa×s [524.10; 901.88] Show Hide
η 0.0006041 Pa×s 524.10 Joback Calculated Property
η 0.0003285 Pa×s 587.06 Joback Calculated Property
η 0.0002010 Pa×s 650.03 Joback Calculated Property
η 0.0001341 Pa×s 712.99 Joback Calculated Property
η 0.0000956 Pa×s 775.95 Joback Calculated Property
η 0.0000717 Pa×s 838.92 Joback Calculated Property
η 0.0000559 Pa×s 901.88 Joback Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, 3-methylphenyl undecyl ester. 1,2-Cyclohexanedicarboxylic acid, dodecyl 3-methylphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-methylphenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, hexyl 3-methylphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-methylphenyl nonyl ester. 1,2-Cyclohexanedicarboxylic acid, decyl 3-methylphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-methylphenyl octyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 3-methylphenyl ester. 1,2-Cyclohexanedicarboxylic acid, isohexyl 3-methylphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-methylphenyl propyl ester. 1,2-Cyclohexanedicarboxylic acid, isobutyl 3-methylphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 3,5-dimethylphenyl pentadecyl ester. 1,2-Cyclohexanedicarboxylic acid, 3,5-dimethylphenyl dodecyl ester. 1,2-Cyclohexanedicarboxylic acid, 3,5-dimethylphenyl heptyl ester. 1,2-Cyclohexanedicarboxylic acid, 3,5-dimethylphenyl pentyl ester.

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, heptyl 3-methylphenyl ester.

Sources

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