Chemical Properties of Diethylmalonic acid, di(1-tert-butyloxyprop-2-yl) ester

Diethylmalonic acid, di(1-tert-butyloxyprop-2-yl) ester

InChI
InChI=1S/C21H40O6/c1-11-21(12-2,17(22)26-15(3)13-24-19(5,6)7)18(23)27-16(4)14-25-20(8,9)10/h15-16H,11-14H2,1-10H3
InChI Key
VRGDRQIILBDECD-UHFFFAOYSA-N
Formula
C21H40O6
SMILES
CCC(CC)(C(=O)OC(C)COC(C)(C)C)C(=O)OC(C)COC(C)(C)C
Molecular Weight1
388.54
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
ΔfH°gas -1408.22 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 31.97 kJ/mol Joback Calculated Property
ΔvapH° 87.95 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.286 Crippen Calculated Property
McVol 333.370 ml/mol McGowan Calculated Property
Pc 985.78 kPa Joback Calculated Property
Inp [1993.00; 1993.00]   Show Hide
Inp 1993.00 NIST
Inp 1993.00 NIST
Tboil 588.99 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Volume, 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 [1080.11; 1170.95] J/mol×K [830.79; 1025.81] Show Hide
Cp,gas 1080.11 J/mol×K 830.79 Joback Calculated Property
Cp,gas 1098.44 J/mol×K 863.29 Joback Calculated Property
Cp,gas 1115.44 J/mol×K 895.80 Joback Calculated Property
Cp,gas 1131.14 J/mol×K 928.30 Joback Calculated Property
Cp,gas 1145.59 J/mol×K 960.81 Joback Calculated Property
Cp,gas 1158.85 J/mol×K 993.31 Joback Calculated Property
Cp,gas 1170.95 J/mol×K 1025.81 Joback Calculated Property
η [0.0000084; 0.0007915] Pa×s [432.81; 830.79] Show Hide
η 0.0007915 Pa×s 432.81 Joback Calculated Property
η 0.0002242 Pa×s 499.14 Joback Calculated Property
η 0.0000854 Pa×s 565.47 Joback Calculated Property
η 0.0000398 Pa×s 631.80 Joback Calculated Property
η 0.0000215 Pa×s 698.13 Joback Calculated Property
η 0.0000129 Pa×s 764.46 Joback Calculated Property
η 0.0000084 Pa×s 830.79 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, ethyl 1-tert-butyloxyprop-2-yl ester. Diethylmalonic acid, propyl 1-tert-butyloxyprop-2-yl ester. Diethylmalonic acid, pentyl 1-tert-butyloxyprop-2-yl ester. Diethylmalonic acid, monochloride, 1-tert-butyloxyprop-2-yl ester. Diethylmalonic acid, 2-ethoxylethyl propyl ester. Diethylmalonic acid, isopropyl propyl ester. Diethylmalonic acid, 2-ethoxylethyl isobutyl ester. Diethylmalonic acid, isobutyl isopropyl ester. Diethylmalonic acid, 2-methoxyethyl propyl ester. Diethylmalonic acid, butyl 2-ethoxylethyl ester. Diethylmalonic acid, ethyl isopropyl ester. Diethylmalonic acid, isobutyl 2-methoxyethyl ester. Diethylmalonic acid, butyl isopropyl ester. Diethylmalonic acid, butyl 2-methoxyethyl ester. Diethylmalonic acid, diisopropyl ester.

Find more compounds similar to Diethylmalonic acid, di(1-tert-butyloxyprop-2-yl) 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.