Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 3-methylbut-2-yl pentyl ester

1,2-Cyclohexanedicarboxylic acid, 3-methylbut-2-yl pentyl ester

InChI
InChI=1S/C18H32O4/c1-5-6-9-12-21-17(19)15-10-7-8-11-16(15)18(20)22-14(4)13(2)3/h13-16H,5-12H2,1-4H3
InChI Key
DDTQSZRDTBBZJM-UHFFFAOYSA-N
Formula
C18H32O4
SMILES
CCCCCOC(=O)C1CCCCC1C(=O)OC(C)C(C)C
Molecular Weight1
312.44
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Physical Properties

Property Value Unit Source
ΔfusH° 36.97 kJ/mol Joback Calculated Property
log10WS -4.35 Relay (1.0) Calculated Property
logPoct/wat 4.114 Crippen Calculated Property
McVol 268.500 ml/mol McGowan Calculated Property
Inp [2032.00; 2032.00]   Show Hide
Inp 2032.00 NIST
Inp 2032.00 NIST
Tboil 593.33 K Relay (1.0) Calculated Property
Tfus 278.61 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 [833.11; 934.12] J/mol×K [741.88; 936.57] Show Hide
Cp,gas 833.11 J/mol×K 741.88 Joback Calculated Property
Cp,gas 853.26 J/mol×K 774.33 Joback Calculated Property
Cp,gas 872.06 J/mol×K 806.78 Joback Calculated Property
Cp,gas 889.53 J/mol×K 839.22 Joback Calculated Property
Cp,gas 905.69 J/mol×K 871.67 Joback Calculated Property
Cp,gas 920.55 J/mol×K 904.12 Joback Calculated Property
Cp,gas 934.12 J/mol×K 936.57 Joback Calculated Property
η [0.0000620; 0.0038220] Pa×s [350.42; 741.88] Show Hide
η 0.0038220 Pa×s 350.42 Joback Calculated Property
η 0.0011217 Pa×s 415.66 Joback Calculated Property
η 0.0004591 Pa×s 480.91 Joback Calculated Property
η 0.0002326 Pa×s 546.15 Joback Calculated Property
η 0.0001363 Pa×s 611.39 Joback Calculated Property
η 0.0000885 Pa×s 676.64 Joback Calculated Property
η 0.0000620 Pa×s 741.88 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 3-methylbut-2-yl pentyl ester.

Sources

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