Chemical Properties of cis-Cyclohex-4-en-1,2-dicarboxylic acid, heptyl isohexyl ester

cis-Cyclohex-4-en-1,2-dicarboxylic acid, heptyl isohexyl ester

InChI
InChI=1S/C21H36O4/c1-4-5-6-7-10-15-24-20(22)18-13-8-9-14-19(18)21(23)25-16-11-12-17(2)3/h8-9,17-19H,4-7,10-16H2,1-3H3
InChI Key
BHBIYJITKKOMFS-UHFFFAOYSA-N
Formula
C21H36O4
SMILES
CCCCCCCOC(=O)C1CC=CCC1C(=O)OCCCC(C)C
Molecular Weight1
352.51
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Physical Properties

Property Value Unit Source
ΔfusH° 46.32 kJ/mol Joback Calculated Property
ΔvapH° 98.05 kJ/mol Relay (1.0) Calculated Property
log10WS -5.28 Relay (1.0) Calculated Property
logPoct/wat 5.062 Crippen Calculated Property
McVol 306.470 ml/mol McGowan Calculated Property
Inp [2342.00; 2342.00]   Show Hide
Inp 2342.00 NIST
Inp 2342.00 NIST
Tboil 624.05 K Relay (1.0) Calculated Property
Tfus 283.39 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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 [1002.95; 1095.45] J/mol×K [846.06; 1044.69] Show Hide
Cp,gas 1002.95 J/mol×K 846.06 Joback Calculated Property
Cp,gas 1021.70 J/mol×K 879.16 Joback Calculated Property
Cp,gas 1039.10 J/mol×K 912.27 Joback Calculated Property
Cp,gas 1055.15 J/mol×K 945.37 Joback Calculated Property
Cp,gas 1069.87 J/mol×K 978.48 Joback Calculated Property
Cp,gas 1083.30 J/mol×K 1011.58 Joback Calculated Property
Cp,gas 1095.45 J/mol×K 1044.69 Joback Calculated Property
η [0.0000608; 0.0010253] Pa×s [459.65; 846.06] Show Hide
η 0.0010253 Pa×s 459.65 Joback Calculated Property
η 0.0004795 Pa×s 524.05 Joback Calculated Property
η 0.0002648 Pa×s 588.45 Joback Calculated Property
η 0.0001644 Pa×s 652.86 Joback Calculated Property
η 0.0001112 Pa×s 717.26 Joback Calculated Property
η 0.0000802 Pa×s 781.66 Joback Calculated Property
η 0.0000608 Pa×s 846.06 Joback Calculated Property

Similar Compounds

cis-Cyclohex-4-en-1,2-dicarboxylic acid, isohexyl nonyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, isohexyl octyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, isohexyl undecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, dodecyl isohexyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, decyl isohexyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, isohexyl octadecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, hexyl isohexyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, butyl undecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, octyl undecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, hexyl tridecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, hexyl undecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, nonyl undecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, heptyl tridecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, butyl octadecyl ester. cis-Cyclohex-4-en-1,2-dicarboxylic acid, decyl undecyl ester.

Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, heptyl isohexyl ester.

Sources

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