Chemical Properties of Diethylmalonic acid, hexyl 2-isopropoxyphenyl ester

Diethylmalonic acid, hexyl 2-isopropoxyphenyl ester

InChI
InChI=1S/C22H34O5/c1-6-9-10-13-16-25-20(23)22(7-2,8-3)21(24)27-19-15-12-11-14-18(19)26-17(4)5/h11-12,14-15,17H,6-10,13,16H2,1-5H3
InChI Key
ZBHWHNJTPAQYTM-UHFFFAOYSA-N
Formula
C22H34O5
SMILES
CCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1OC(C)C
Molecular Weight1
378.50
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° 45.38 kJ/mol Joback Calculated Property
log10WS -4.77 Relay (1.0) Calculated Property
logPoct/wat 5.309 Crippen Calculated Property
McVol 317.830 ml/mol McGowan Calculated Property
Pc 1115.57 kPa Joback Calculated Property
Inp 2339.00 NIST
Tboil 625.06 K Relay (1.0) Calculated Property
Tfus 305.51 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 [1014.07; 1092.46] J/mol×K [869.81; 1073.77] Show Hide
Cp,gas 1014.07 J/mol×K 869.81 Joback Calculated Property
Cp,gas 1030.46 J/mol×K 903.80 Joback Calculated Property
Cp,gas 1045.47 J/mol×K 937.80 Joback Calculated Property
Cp,gas 1059.14 J/mol×K 971.79 Joback Calculated Property
Cp,gas 1071.50 J/mol×K 1005.79 Joback Calculated Property
Cp,gas 1082.60 J/mol×K 1039.78 Joback Calculated Property
Cp,gas 1092.46 J/mol×K 1073.77 Joback Calculated Property
η [0.0000169; 0.0005332] Pa×s [470.95; 869.81] Show Hide
η 0.0005332 Pa×s 470.95 Joback Calculated Property
η 0.0002102 Pa×s 537.43 Joback Calculated Property
η 0.0001017 Pa×s 603.90 Joback Calculated Property
η 0.0000568 Pa×s 670.38 Joback Calculated Property
η 0.0000353 Pa×s 736.86 Joback Calculated Property
η 0.0000237 Pa×s 803.33 Joback Calculated Property
η 0.0000169 Pa×s 869.81 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, dodecyl 2-isopropoxyphenyl ester. Diethylmalonic acid, heptyl 2-isopropoxyphenyl ester. Diethylmalonic acid, hexadecyl 2-isopropoxyphenyl ester. Diethylmalonic acid, 2-isopropoxyphenyl tetradecyl ester. Diethylmalonic acid, 2-isopropoxyphenyl octyl ester. Diethylmalonic acid, 2-isopropoxyphenyl pentadecyl ester. Diethylmalonic acid, 2-isopropoxyphenyl tridecyl ester. Diethylmalonic acid, heptadecyl 2-isopropoxyphenyl ester. Diethylmalonic acid, 2-isopropoxyphenyl nonyl ester. Diethylmalonic acid, 2-isopropoxyphenyl pentyl ester. Diethylmalonic acid, butyl 2-isopropoxyphenyl ester. Diethylmalonic acid, isobutyl 2-isopropoxyphenyl ester. Diethylmalonic acid, decyl 2,6-dimethoxyphenyl ester. Diethylmalonic acid, 2,6-dimethoxyphenyl nonyl ester. Diethylmalonic acid, 2,6-dimethoxyphenyl heptyl ester.

Find more compounds similar to Diethylmalonic acid, hexyl 2-isopropoxyphenyl 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.