Chemical Properties of Diethylmalonic acid, 4-chloro-3-methylphenyl heptyl ester

Diethylmalonic acid, 4-chloro-3-methylphenyl heptyl ester

InChI
InChI=1S/C21H31ClO4/c1-5-8-9-10-11-14-25-19(23)21(6-2,7-3)20(24)26-17-12-13-18(22)16(4)15-17/h12-13,15H,5-11,14H2,1-4H3
InChI Key
XKPVVNKJBQMMOG-UHFFFAOYSA-N
Formula
C21H31ClO4
SMILES
CCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc(Cl)c(C)c1
Molecular Weight1
382.93
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
Δfus 48.93 kJ/mol Joback Calculated Property
logPoct/wat 5.874 Crippen Calculated Property
McVol 310.110 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Ionization energy, 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 [951.55; 1025.84] J/mol×K [867.36; 1073.50] Show Hide
Cp,gas 951.55 J/mol×K 867.36 Joback Calculated Property
Cp,gas 966.91 J/mol×K 901.72 Joback Calculated Property
Cp,gas 981.01 J/mol×K 936.07 Joback Calculated Property
Cp,gas 993.92 J/mol×K 970.43 Joback Calculated Property
Cp,gas 1005.66 J/mol×K 1004.79 Joback Calculated Property
Cp,gas 1016.28 J/mol×K 1039.15 Joback Calculated Property
Cp,gas 1025.84 J/mol×K 1073.50 Joback Calculated Property
η [0.0000249; 0.0004805] Pa×s [494.89; 867.36] Show Hide
η 0.0004805 Pa×s 494.89 Joback Calculated Property
η 0.0002229 Pa×s 556.97 Joback Calculated Property
η 0.0001206 Pa×s 619.05 Joback Calculated Property
η 0.0000730 Pa×s 681.12 Joback Calculated Property
η 0.0000481 Pa×s 743.20 Joback Calculated Property
η 0.0000337 Pa×s 805.28 Joback Calculated Property
η 0.0000249 Pa×s 867.36 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 4-chloro-3-methylphenyl dodecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl hexadecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl tridecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl tetradecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl pentadecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl nonyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl hexyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl octyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl decyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl heptadecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl undecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl pentyl ester. Diethylmalonic acid, butyl 4-chloro-3-methylphenyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl propyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl isobutyl ester.

Find more compounds similar to Diethylmalonic acid, 4-chloro-3-methylphenyl heptyl 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.