Chemical Properties of Diethylmalonic acid, 2,3-dimethylphenyl dodecyl ester

Diethylmalonic acid, 2,3-dimethylphenyl dodecyl ester

InChI
InChI=1S/C27H44O4/c1-6-9-10-11-12-13-14-15-16-17-21-30-25(28)27(7-2,8-3)26(29)31-24-20-18-19-22(4)23(24)5/h18-20H,6-17,21H2,1-5H3
InChI Key
PGBOPQDIQHZDSI-UHFFFAOYSA-N
Formula
C27H44O4
SMILES
CCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1cccc(C)c1C
Molecular Weight1
432.64
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° 60.27 kJ/mol Joback Calculated Property
log10WS -6.96 Relay (1.0) Calculated Property
logPoct/wat 7.479 Crippen Calculated Property
McVol 382.410 ml/mol McGowan Calculated Property
Pc 825.74 kPa Joback Calculated Property
Inp [2903.00; 2903.00]   Show Hide
Inp 2903.00 NIST
Inp 2903.00 NIST
Tboil 666.68 K Relay (1.0) Calculated Property
Tfus 317.71 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 [1289.36; 1372.97] J/mol×K [967.21; 1184.16] Show Hide
Cp,gas 1289.36 J/mol×K 967.21 Joback Calculated Property
Cp,gas 1306.93 J/mol×K 1003.37 Joback Calculated Property
Cp,gas 1322.96 J/mol×K 1039.53 Joback Calculated Property
Cp,gas 1337.51 J/mol×K 1075.69 Joback Calculated Property
Cp,gas 1350.64 J/mol×K 1111.84 Joback Calculated Property
Cp,gas 1362.44 J/mol×K 1148.00 Joback Calculated Property
Cp,gas 1372.97 J/mol×K 1184.16 Joback Calculated Property
η [0.0000115; 0.0002838] Pa×s [532.59; 967.21] Show Hide
η 0.0002838 Pa×s 532.59 Joback Calculated Property
η 0.0001207 Pa×s 605.03 Joback Calculated Property
η 0.0000616 Pa×s 677.46 Joback Calculated Property
η 0.0000358 Pa×s 749.90 Joback Calculated Property
η 0.0000229 Pa×s 822.34 Joback Calculated Property
η 0.0000158 Pa×s 894.77 Joback Calculated Property
η 0.0000115 Pa×s 967.21 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 2,3-dimethylphenyl pentadecyl ester. Diethylmalonic acid, 2,3-dimethylphenyl tetradecyl ester. Diethylmalonic acid, 2,3-dimethylphenyl nonyl ester. Diethylmalonic acid, 2,3-dimethylphenyl octyl ester. Diethylmalonic acid, 2,3-dimethylphenyl heptadecyl ester. Diethylmalonic acid, 2,3-dimethylphenyl heptyl ester. Diethylmalonic acid, 2,3-dimethylphenyl tridecyl ester. Diethylmalonic acid, 2,3-dimethylphenyl hexyl ester. Diethylmalonic acid, 2,3-dimethylphenyl hexadecyl ester. Diethylmalonic acid, decyl 2,3-dimethylphenyl ester. Diethylmalonic acid, 2,3-dimethylphenyl octadecyl ester. Diethylmalonic acid, 2,3-dimethylphenyl undecyl ester. Diethylmalonic acid, 2,3-dimethylphenyl pentyl ester. Diethylmalonic acid, butyl 2,3-dimethylphenyl ester. Diethylmalonic acid, 2,3-dimethylphenyl propyl ester.

Find more compounds similar to Diethylmalonic acid, 2,3-dimethylphenyl dodecyl 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.