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

1,2-Cyclohexanedicarboxylic acid, heptyl 2-methylpent-3-yl ester

InChI
InChI=1S/C21H38O4/c1-5-7-8-9-12-15-24-20(22)17-13-10-11-14-18(17)21(23)25-19(6-2)16(3)4/h16-19H,5-15H2,1-4H3
InChI Key
FANMCFKLQGEBMK-UHFFFAOYSA-N
Formula
C21H38O4
SMILES
CCCCCCCOC(=O)C1CCCCC1C(=O)OC(CC)C(C)C
Molecular Weight1
354.52
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Physical Properties

Property Value Unit Source
ΔfusH° 41.58 kJ/mol Joback Calculated Property
log10WS -5.25 Relay (1.0) Calculated Property
logPoct/wat 5.284 Crippen Calculated Property
McVol 310.770 ml/mol McGowan Calculated Property
Inp [2369.00; 2369.00]   Show Hide
Inp 2369.00 NIST
Inp 2369.00 NIST
Tboil 625.41 K Relay (1.0) Calculated Property
Tfus 280.17 K Relay (1.0) Calculated Property

Cheméo can also estimate 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, 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 [1031.88; 1128.41] J/mol×K [846.46; 1046.00] Show Hide
Cp,gas 1031.88 J/mol×K 846.46 Joback Calculated Property
Cp,gas 1051.50 J/mol×K 879.72 Joback Calculated Property
Cp,gas 1069.67 J/mol×K 912.97 Joback Calculated Property
Cp,gas 1086.43 J/mol×K 946.23 Joback Calculated Property
Cp,gas 1101.80 J/mol×K 979.48 Joback Calculated Property
Cp,gas 1115.78 J/mol×K 1012.74 Joback Calculated Property
Cp,gas 1128.41 J/mol×K 1046.00 Joback Calculated Property
η [0.0000516; 0.0012526] Pa×s [443.89; 846.46] Show Hide
η 0.0012526 Pa×s 443.89 Joback Calculated Property
η 0.0005193 Pa×s 510.98 Joback Calculated Property
η 0.0002641 Pa×s 578.08 Joback Calculated Property
η 0.0001546 Pa×s 645.17 Joback Calculated Property
η 0.0001001 Pa×s 712.27 Joback Calculated Property
η 0.0000699 Pa×s 779.36 Joback Calculated Property
η 0.0000516 Pa×s 846.46 Joback Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl nonyl ester. 1,2-Cyclohexanedicarboxylic acid, hexadecyl 2-methylpent-3-yl ester. 1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl octyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl octadecyl ester. 1,2-Cyclohexanedicarboxylic acid, decyl 2-methylpent-3-yl ester. 1,2-Cyclohexanedicarboxylic acid, dodecyl 2-methylpent-3-yl ester. 1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl undecyl ester. 1,2-Cyclohexanedicarboxylic acid, hexyl 2-methylpent-3-yl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 2-methylpent-3-yl ester. 1,2-Cyclohexanedicarboxylic acid, 2-methylcyclohexyl undecyl ester. 1,2-Cyclohexanedicarboxylic acid, isohexyl 2-methylcyclohexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-methylcyclohexyl tetradecyl ester. 1,2-Cyclohexanedicarboxylic acid, hexyl 2-methylcyclohexyl ester. 1,2-Cyclohexanedicarboxylic acid, heptadecyl 2-methylcyclohexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-methylcyclohexyl pentadecyl ester.

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

Sources

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