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

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

InChI
InChI=1S/C27H42O4/c1-3-4-5-6-7-8-9-10-11-14-20-30-26(28)24-18-12-13-19-25(24)27(29)31-23-17-15-16-22(2)21-23/h15-17,21,24-25H,3-14,18-20H2,1-2H3
InChI Key
PTDNNQMIUOANCB-UHFFFAOYSA-N
Formula
C27H42O4
SMILES
CCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)Oc1cccc(C)c1
Molecular Weight1
430.62
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Physical Properties

Property Value Unit Source
ΔfusH° 60.98 kJ/mol Joback Calculated Property
IE 8.59 eV Relay (1.0) Calculated Property
logPoct/wat 7.171 Crippen Calculated Property
McVol 371.550 ml/mol McGowan Calculated Property
Inp [3147.00; 3147.00]   Show Hide
Inp 3147.00 NIST
Inp 3147.00 NIST
Tboil 695.92 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 [1289.37; 1363.64] J/mol×K [980.34; 1201.09] Show Hide
Cp,gas 1289.37 J/mol×K 980.34 Joback Calculated Property
Cp,gas 1306.33 J/mol×K 1017.13 Joback Calculated Property
Cp,gas 1321.38 J/mol×K 1053.92 Joback Calculated Property
Cp,gas 1334.59 J/mol×K 1090.71 Joback Calculated Property
Cp,gas 1345.99 J/mol×K 1127.50 Joback Calculated Property
Cp,gas 1355.66 J/mol×K 1164.30 Joback Calculated Property
Cp,gas 1363.64 J/mol×K 1201.09 Joback Calculated Property
η [0.0000202; 0.0004682] Pa×s [520.79; 980.34] Show Hide
η 0.0004682 Pa×s 520.79 Joback Calculated Property
η 0.0001982 Pa×s 597.38 Joback Calculated Property
η 0.0001020 Pa×s 673.97 Joback Calculated Property
η 0.0000601 Pa×s 750.56 Joback Calculated Property
η 0.0000391 Pa×s 827.16 Joback Calculated Property
η 0.0000273 Pa×s 903.75 Joback Calculated Property
η 0.0000202 Pa×s 980.34 Joback Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, 3-methylphenyl undecyl 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, heptyl 3-methylphenyl 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, dodecyl 3-methylphenyl ester.

Sources

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