Chemical Properties of Cyclohexanecarboxylic acid, 4-cyanophenyl ester

Cyclohexanecarboxylic acid, 4-cyanophenyl ester

InChI
InChI=1S/C14H15NO2/c15-10-11-6-8-13(9-7-11)17-14(16)12-4-2-1-3-5-12/h6-9,12H,1-5H2
InChI Key
UHVXYUDWPRIRGD-UHFFFAOYSA-N
Formula
C14H15NO2
SMILES
N#Cc1ccc(OC(=O)C2CCCCC2)cc1
Molecular Weight1
229.27
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Physical Properties

Property Value Unit Source
Δfus 21.80 kJ/mol Joback Calculated Property
logPoct/wat 3.044 Crippen Calculated Property
McVol 182.320 ml/mol McGowan Calculated Property
Inp [1896.00; 1896.00]   Show Hide
Inp 1896.00 NIST
Inp 1896.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [515.61; 588.37] J/mol×K [749.30; 996.36] Show Hide
Cp,gas 515.61 J/mol×K 749.30 Joback Calculated Property
Cp,gas 530.96 J/mol×K 790.48 Joback Calculated Property
Cp,gas 544.97 J/mol×K 831.65 Joback Calculated Property
Cp,gas 557.67 J/mol×K 872.83 Joback Calculated Property
Cp,gas 569.11 J/mol×K 914.01 Joback Calculated Property
Cp,gas 579.33 J/mol×K 955.18 Joback Calculated Property
Cp,gas 588.37 J/mol×K 996.36 Joback Calculated Property

Similar Compounds

Cyclopentanecarboxylic acid, 4-cyanophenyl ester. Cyclobutanecarboxylic acid, 4-cyanophenyl ester. Cyclohexanecarboxylic acid, 4-methoxyphenyl ester. 2-Ethylbutyric acid, 4-cyanophenyl ester. Cyclopentanecarboxylic acid, phenyl ester. Cyclohexanecarboxylic acid, 3-methylphenyl ester. 1-Adamantanecarboxylic acid, 4-cyanophenyl ester. Cyclopentanecarboxylic acid, 4-methoxyphenyl ester. 3-Cyclopentylpropionic acid, 4-cyanophenyl ester. Cyclohexanecarboxylic acid, 2-naphthyl ester. Cyclopentanecarboxylic acid, 3-methylphenyl ester. Cyclohexanecarboxylic acid, 4-butyl-, 4-ethoxyphenyl ester, trans-. Cyclopentanecarboxylic acid, 4-chlorophenyl ester. Cyclohexanecarboxylic acid, 4-nitrophenyl ester. 2-Methylvaleric acid, phenyl ester.

Find more compounds similar to Cyclohexanecarboxylic acid, 4-cyanophenyl ester.

Sources

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