Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, butyl 3-chlorophenyl ester

1,2-Cyclohexanedicarboxylic acid, butyl 3-chlorophenyl ester

InChI
InChI=1S/C18H23ClO4/c1-2-3-11-22-17(20)15-9-4-5-10-16(15)18(21)23-14-8-6-7-13(19)12-14/h6-8,12,15-16H,2-5,9-11H2,1H3
InChI Key
XAJFXAAMXAZOMM-UHFFFAOYSA-N
Formula
C18H23ClO4
SMILES
CCCCOC(=O)C1CCCCC1C(=O)Oc1cccc(Cl)c1
Molecular Weight1
338.83
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 41.87 kJ/mol Joback Calculated Property
IE 8.75 eV Relay (1.0) Calculated Property
logPoct/wat 4.395 Crippen Calculated Property
McVol 256.980 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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 [775.12; 850.80] J/mol×K [811.85; 1034.61] Show Hide
Cp,gas 775.12 J/mol×K 811.85 Joback Calculated Property
Cp,gas 791.61 J/mol×K 848.98 Joback Calculated Property
Cp,gas 806.51 J/mol×K 886.10 Joback Calculated Property
Cp,gas 819.85 J/mol×K 923.23 Joback Calculated Property
Cp,gas 831.67 J/mol×K 960.36 Joback Calculated Property
Cp,gas 841.98 J/mol×K 997.48 Joback Calculated Property
Cp,gas 850.80 J/mol×K 1034.61 Joback Calculated Property
η [0.0000647; 0.0010623] Pa×s [449.28; 811.85] Show Hide
η 0.0010623 Pa×s 449.28 Joback Calculated Property
η 0.0005054 Pa×s 509.71 Joback Calculated Property
η 0.0002815 Pa×s 570.14 Joback Calculated Property
η 0.0001754 Pa×s 630.56 Joback Calculated Property
η 0.0001187 Pa×s 690.99 Joback Calculated Property
η 0.0000855 Pa×s 751.42 Joback Calculated Property
η 0.0000647 Pa×s 811.85 Joback Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, 3-chlorophenyl undecyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-chlorophenyl hexyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-chlorophenyl propyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-chlorophenyl isobutyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 2,5-dichlorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 2-chlorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl nonyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl heptyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl octyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl hexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 4-chlorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, butyl 2,3-dichlorophenyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl hexyl ester. 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl pentadecyl ester.

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, butyl 3-chlorophenyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.