Chemical Properties of Succinic acid, dec-2-yl 4-cyanophenyl ester

Succinic acid, dec-2-yl 4-cyanophenyl ester

InChI
InChI=1S/C21H29NO4/c1-3-4-5-6-7-8-9-17(2)25-20(23)14-15-21(24)26-19-12-10-18(16-22)11-13-19/h10-13,17H,3-9,14-15H2,1-2H3
InChI Key
CWGVRGAILWBSMO-UHFFFAOYSA-N
Formula
C21H29NO4
SMILES
CCCCCCCCC(C)OC(=O)CCC(=O)Oc1ccc(C#N)cc1
Molecular Weight1
359.46
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° 50.52 kJ/mol Joback Calculated Property
IE 9.02 eV Relay (1.0) Calculated Property
logPoct/wat 4.926 Crippen Calculated Property
McVol 299.250 ml/mol McGowan Calculated Property
Inp [2735.00; 2735.00]   Show Hide
Inp 2735.00 NIST
Inp 2735.00 NIST
Tboil 662.33 K Relay (1.0) Calculated Property
Tfus 319.44 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [949.75; 1009.43] J/mol×K [929.82; 1143.50] Show Hide
Cp,gas 949.75 J/mol×K 929.82 Joback Calculated Property
Cp,gas 962.91 J/mol×K 965.43 Joback Calculated Property
Cp,gas 974.74 J/mol×K 1001.05 Joback Calculated Property
Cp,gas 985.27 J/mol×K 1036.66 Joback Calculated Property
Cp,gas 994.55 J/mol×K 1072.27 Joback Calculated Property
Cp,gas 1002.59 J/mol×K 1107.89 Joback Calculated Property
Cp,gas 1009.43 J/mol×K 1143.50 Joback Calculated Property

Similar Compounds

Succinic acid, hept-2-yl 4-cyanophenyl ester. Glutaric acid, hept-2-yl 4-cyanophenyl ester. Glutaric acid, dec-2-yl 4-cyanophenyl ester. Succinic acid, hept-2-yl 4-acetylphenyl ester. Succinic acid, dec-2-yl 4-acetylphenyl ester. Succinic acid, dec-2-yl 4-methoxyphenyl ester. Succinic acid, 2-methylpent-3-yl 4-cyanophenyl ester. Succinic acid, hept-2-yl 2-naphthyl ester. Succinic acid, dec-2-yl 2-naphthyl ester. Succinic acid, hept-2-yl 4-bromophenyl ester. Succinic acid, dec-2-yl 4-bromophenyl ester. Succinic acid, hept-2-yl 3-methoxyphenyl ester. Succinic acid, dec-2-yl 3-methoxyphenyl ester. Succinic acid, dec-2-yl 3-fluorophenyl ester. Succinic acid, hept-2-yl 3-fluorophenyl ester.

Find more compounds similar to Succinic acid, dec-2-yl 4-cyanophenyl 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.