Chemical Properties of Diethylmalonic acid, 3-chlorobenzyl hexyl ester

Diethylmalonic acid, 3-chlorobenzyl hexyl ester

InChI
InChI=1S/C20H29ClO4/c1-4-7-8-9-13-24-18(22)20(5-2,6-3)19(23)25-15-16-11-10-12-17(21)14-16/h10-12,14H,4-9,13,15H2,1-3H3
InChI Key
LTEYYOARQYIPLI-UHFFFAOYSA-N
Formula
C20H29ClO4
SMILES
CCCCCCOC(=O)C(CC)(CC)C(=O)OCc1cccc(Cl)c1
Molecular Weight1
368.89
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Physical Properties

Property Value Unit Source
ΔfusH° 46.73 kJ/mol Joback Calculated Property
log10WS -5.53 Relay (1.0) Calculated Property
logPoct/wat 5.313 Crippen Calculated Property
McVol 296.020 ml/mol McGowan Calculated Property
Pc 1248.61 kPa Joback Calculated Property
Inp 2349.00 NIST
Tboil 633.46 K Relay (1.0) Calculated Property
Tfus 277.10 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 [893.73; 968.36] J/mol×K [839.50; 1044.46] Show Hide
Cp,gas 893.73 J/mol×K 839.50 Joback Calculated Property
Cp,gas 909.06 J/mol×K 873.66 Joback Calculated Property
Cp,gas 923.18 J/mol×K 907.82 Joback Calculated Property
Cp,gas 936.12 J/mol×K 941.98 Joback Calculated Property
Cp,gas 947.93 J/mol×K 976.14 Joback Calculated Property
Cp,gas 958.66 J/mol×K 1010.30 Joback Calculated Property
Cp,gas 968.36 J/mol×K 1044.46 Joback Calculated Property
η [0.0000289; 0.0006647] Pa×s [471.10; 839.50] Show Hide
η 0.0006647 Pa×s 471.10 Joback Calculated Property
η 0.0002916 Pa×s 532.50 Joback Calculated Property
η 0.0001516 Pa×s 593.90 Joback Calculated Property
η 0.0000891 Pa×s 655.30 Joback Calculated Property
η 0.0000574 Pa×s 716.70 Joback Calculated Property
η 0.0000396 Pa×s 778.10 Joback Calculated Property
η 0.0000289 Pa×s 839.50 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 3-chlorobenzyl nonyl ester. Diethylmalonic acid, 3-chlorobenzyl hexadecyl ester. Diethylmalonic acid, 3-chlorobenzyl dodecyl ester. Diethylmalonic acid, 3-chlorobenzyl pentadecyl ester. Diethylmalonic acid, 3-chlorobenzyl heptyl ester. Diethylmalonic acid, 3-chlorobenzyl octyl ester. Diethylmalonic acid, 3-chlorobenzyl heptadecyl ester. Diethylmalonic acid, 3-chlorobenzyl undecyl ester. Diethylmalonic acid, 3-chlorobenzyl tridecyl ester. Diethylmalonic acid, 3-chlorobenzyl tetradecyl ester. Diethylmalonic acid, 3-chlorobenzyl pentyl ester. Diethylmalonic acid, butyl 3-chlorobenzyl ester. Diethylmalonic acid, 3-chlorobenzyl propyl ester. Diethylmalonic acid, 4-chlorobenzyl tridecyl ester. Diethylmalonic acid, 4-chlorobenzyl undecyl ester.

Find more compounds similar to Diethylmalonic acid, 3-chlorobenzyl hexyl ester.

Sources

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