Chemical Properties of Diethylmalonic acid, hexadecyl 3-methylphenyl ester

Diethylmalonic acid, hexadecyl 3-methylphenyl ester

InChI
InChI=1S/C30H50O4/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-24-33-28(31)30(6-2,7-3)29(32)34-27-23-21-22-26(4)25-27/h21-23,25H,5-20,24H2,1-4H3
InChI Key
PMPCUOICRDXDRU-UHFFFAOYSA-N
Formula
C30H50O4
SMILES
CCCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1cccc(C)c1
Molecular Weight1
474.73
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° 68.43 kJ/mol Joback Calculated Property
IE 8.60 eV Relay (1.0) Calculated Property
log10WS -8.05 Relay (1.0) Calculated Property
logPoct/wat 8.731 Crippen Calculated Property
McVol 424.680 ml/mol McGowan Calculated Property
Pc 709.97 kPa Joback Calculated Property
Tboil 692.51 K Relay (1.0) Calculated Property
Tfus 312.59 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 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 [1479.06; 1565.89] J/mol×K [1030.87; 1267.57] Show Hide
Cp,gas 1479.06 J/mol×K 1030.87 Joback Calculated Property
Cp,gas 1497.66 J/mol×K 1070.32 Joback Calculated Property
Cp,gas 1514.46 J/mol×K 1109.77 Joback Calculated Property
Cp,gas 1529.57 J/mol×K 1149.22 Joback Calculated Property
Cp,gas 1543.10 J/mol×K 1188.67 Joback Calculated Property
Cp,gas 1555.17 J/mol×K 1228.12 Joback Calculated Property
Cp,gas 1565.89 J/mol×K 1267.57 Joback Calculated Property
η [0.0000068; 0.0002166] Pa×s [553.88; 1030.87] Show Hide
η 0.0002166 Pa×s 553.88 Joback Calculated Property
η 0.0000848 Pa×s 633.38 Joback Calculated Property
η 0.0000409 Pa×s 712.88 Joback Calculated Property
η 0.0000229 Pa×s 792.38 Joback Calculated Property
η 0.0000142 Pa×s 871.87 Joback Calculated Property
η 0.0000096 Pa×s 951.37 Joback Calculated Property
η 0.0000068 Pa×s 1030.87 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to Diethylmalonic acid, hexadecyl 3-methylphenyl 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.