Chemical Properties of Diethylmalonic acid, 3-methylbenzyl octadecyl ester

Diethylmalonic acid, 3-methylbenzyl octadecyl ester

InChI
InChI=1S/C33H56O4/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-36-31(34)33(6-2,7-3)32(35)37-28-30-25-23-24-29(4)27-30/h23-25,27H,5-22,26,28H2,1-4H3
InChI Key
VMGZEHKIGZLICW-UHFFFAOYSA-N
Formula
C33H56O4
SMILES
CCCCCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)OCc1cccc(C)c1
Molecular Weight1
516.81
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Physical Properties

Property Value Unit Source
ΔfusH° 76.20 kJ/mol Joback Calculated Property
IE 8.80 eV Relay (1.0) Calculated Property
log10WS -8.59 Relay (1.0) Calculated Property
logPoct/wat 9.649 Crippen Calculated Property
McVol 466.950 ml/mol McGowan Calculated Property
Pc 612.38 kPa Joback Calculated Property
Tboil 710.08 K Relay (1.0) Calculated Property
Tfus 295.66 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 [1671.05; 1761.13] J/mol×K [1099.51; 1368.73] Show Hide
Cp,gas 1671.05 J/mol×K 1099.51 Joback Calculated Property
Cp,gas 1691.00 J/mol×K 1144.38 Joback Calculated Property
Cp,gas 1708.73 J/mol×K 1189.25 Joback Calculated Property
Cp,gas 1724.43 J/mol×K 1234.12 Joback Calculated Property
Cp,gas 1738.27 J/mol×K 1278.99 Joback Calculated Property
Cp,gas 1750.44 J/mol×K 1323.86 Joback Calculated Property
Cp,gas 1761.13 J/mol×K 1368.73 Joback Calculated Property
η [0.0000041; 0.0001366] Pa×s [587.69; 1099.51] Show Hide
η 0.0001366 Pa×s 587.69 Joback Calculated Property
η 0.0000526 Pa×s 672.99 Joback Calculated Property
η 0.0000251 Pa×s 758.30 Joback Calculated Property
η 0.0000139 Pa×s 843.60 Joback Calculated Property
η 0.0000086 Pa×s 928.90 Joback Calculated Property
η 0.0000058 Pa×s 1014.21 Joback Calculated Property
η 0.0000041 Pa×s 1099.51 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 3-methylbenzyl tetradecyl ester. Diethylmalonic acid, hexadecyl 3-methylbenzyl ester. Diethylmalonic acid, heptyl 3-methylbenzyl ester. Diethylmalonic acid, heptadecyl 3-methylbenzyl ester. Diethylmalonic acid, 3-methylbenzyl octyl ester. Diethylmalonic acid, dodecyl 3-methylbenzyl ester. Diethylmalonic acid, 3-methylbenzyl undecyl ester. Diethylmalonic acid, decyl 3-methylbenzyl ester. Diethylmalonic acid, 3-methylbenzyl tridecyl ester. Diethylmalonic acid, 3-methylbenzyl hexyl ester. Diethylmalonic acid, 3-methylbenzyl pentyl ester. Diethylmalonic acid, butyl 3-methylbenzyl ester. Diethylmalonic acid, 3-methylbenzyl propyl ester. Diethylmalonic acid, isobutyl 3-methylbenzyl ester. Diethylmalonic acid, octyl 4-trifluoromethylbenzyl ester.

Find more compounds similar to Diethylmalonic acid, 3-methylbenzyl octadecyl ester.

Sources

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