Chemical Properties of Glutaric acid, 2-ethylhexyl 4-cyanophenyl ester

Glutaric acid, 2-ethylhexyl 4-cyanophenyl ester

InChI
InChI=1S/C20H27NO4/c1-3-5-7-16(4-2)15-24-19(22)8-6-9-20(23)25-18-12-10-17(14-21)11-13-18/h10-13,16H,3-9,15H2,1-2H3
InChI Key
PNUDLLIBKNIMPR-UHFFFAOYSA-N
Formula
C20H27NO4
SMILES
CCCCC(CC)COC(=O)CCCC(=O)Oc1ccc(C#N)cc1
Molecular Weight1
345.44
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Physical Properties

Property Value Unit Source
ΔfusH° 47.93 kJ/mol Joback Calculated Property
log10WS -5.25 Relay (1.0) Calculated Property
logPoct/wat 4.394 Crippen Calculated Property
McVol 285.160 ml/mol McGowan Calculated Property
Pc 1249.49 kPa Joback Calculated Property
Inp [2754.00; 2754.00]   Show Hide
Inp 2754.00 NIST
Inp 2754.00 NIST
Tboil 669.36 K Relay (1.0) Calculated Property
Tfus 280.91 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, 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 [891.20; 950.90] J/mol×K [906.94; 1119.01] Show Hide
Cp,gas 891.20 J/mol×K 906.94 Joback Calculated Property
Cp,gas 904.25 J/mol×K 942.28 Joback Calculated Property
Cp,gas 916.02 J/mol×K 977.63 Joback Calculated Property
Cp,gas 926.54 J/mol×K 1012.97 Joback Calculated Property
Cp,gas 935.84 J/mol×K 1048.32 Joback Calculated Property
Cp,gas 943.95 J/mol×K 1083.66 Joback Calculated Property
Cp,gas 950.90 J/mol×K 1119.01 Joback Calculated Property

Similar Compounds

Glutaric acid, cyclohexylmethyl 4-cyanophenyl ester. Succinic acid, 2-ethylhexyl 4-cyanophenyl ester. Succinic acid, cyclohexylmethyl 4-cyanophenyl ester. Glutaric acid, 4-cyanophenyl isohexyl ester. Glutaric acid, 2-ethylhexyl 4-bromophenyl ester. Glutaric acid, 2-ethylhexyl 4-acetylphenyl ester. Sebacic acid, 4-cyanophenyl isohexyl ester. Glutaric acid, 2-ethylhexyl 3-methylphenyl ester. Glutaric acid, 2-fluorophenyl 2-ethylhexyl ester. Glutaric acid, cyclohexylmethyl 4-acetylphenyl ester. Glutaric acid, cyclohexylmethyl 3-methylphenyl ester. Glutaric acid, cyclohexylmethyl 4-bromophenyl ester. Glutaric acid, 2-ethylhexyl 2-methoxyphenyl ester. Glutaric acid, 2-ethylhexyl 1-naphthyl ester. Glutaric acid, 4-cyanophenyl heptyl ester.

Find more compounds similar to Glutaric acid, 2-ethylhexyl 4-cyanophenyl ester.

Sources

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