Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl octyl ester

1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl octyl ester

InChI
InChI=1S/C22H31ClO4/c1-2-3-4-5-6-11-16-26-21(24)17-12-7-8-13-18(17)22(25)27-20-15-10-9-14-19(20)23/h9-10,14-15,17-18H,2-8,11-13,16H2,1H3
InChI Key
DTWFJLCEMPKWOP-UHFFFAOYSA-N
Formula
C22H31ClO4
SMILES
CCCCCCCCOC(=O)C1CCCCC1C(=O)Oc1ccccc1Cl
Molecular Weight1
394.93
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Physical Properties

Property Value Unit Source
ΔfusH° 52.23 kJ/mol Joback Calculated Property
IE 8.69 eV Relay (1.0) Calculated Property
log10WS -6.26 Relay (1.0) Calculated Property
logPoct/wat 5.955 Crippen Calculated Property
McVol 313.340 ml/mol McGowan Calculated Property
Pc 1214.90 kPa Joback Calculated Property
Inp [2795.00; 2795.00]   Show Hide
Inp 2795.00 NIST
Inp 2795.00 NIST
Tboil 657.60 K Relay (1.0) Calculated Property
Tfus 319.79 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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 [1010.06; 1081.64] J/mol×K [903.37; 1120.70] Show Hide
Cp,gas 1010.06 J/mol×K 903.37 Joback Calculated Property
Cp,gas 1026.04 J/mol×K 939.59 Joback Calculated Property
Cp,gas 1040.34 J/mol×K 975.81 Joback Calculated Property
Cp,gas 1053.02 J/mol×K 1012.04 Joback Calculated Property
Cp,gas 1064.11 J/mol×K 1048.26 Joback Calculated Property
Cp,gas 1073.63 J/mol×K 1084.48 Joback Calculated Property
Cp,gas 1081.64 J/mol×K 1120.70 Joback Calculated Property
η [0.0000363; 0.0006759] Pa×s [494.36; 903.37] Show Hide
η 0.0006759 Pa×s 494.36 Joback Calculated Property
η 0.0003091 Pa×s 562.53 Joback Calculated Property
η 0.0001674 Pa×s 630.70 Joback Calculated Property
η 0.0001022 Pa×s 698.87 Joback Calculated Property
η 0.0000681 Pa×s 767.03 Joback Calculated Property
η 0.0000485 Pa×s 835.20 Joback Calculated Property
η 0.0000363 Pa×s 903.37 Joback Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl hexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl pentadecyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl undecyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl dodecyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 2-chlorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl isohexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,3-dichlorophenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,3-dichlorophenyl hexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,3-dichlorophenyl heptyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl hexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl octyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl nonyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl heptyl ester.

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl octyl ester.

Sources

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