Chemical Properties of Diethylmalonic acid, 3-methylbenzyl pentyl ester

Diethylmalonic acid, 3-methylbenzyl pentyl ester

InChI
InChI=1S/C20H30O4/c1-5-8-9-13-23-18(21)20(6-2,7-3)19(22)24-15-17-12-10-11-16(4)14-17/h10-12,14H,5-9,13,15H2,1-4H3
InChI Key
STSLILJPOYTXAE-UHFFFAOYSA-N
Formula
C20H30O4
SMILES
CCCCCOC(=O)C(CC)(CC)C(=O)OCc1cccc(C)c1
Molecular Weight1
334.45
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Physical Properties

Property Value Unit Source
ΔfusH° 42.53 kJ/mol Joback Calculated Property
IE 8.39 eV Relay (1.0) Calculated Property
log10WS -4.72 Relay (1.0) Calculated Property
logPoct/wat 4.578 Crippen Calculated Property
McVol 283.780 ml/mol McGowan Calculated Property
Pc 1281.91 kPa Joback Calculated Property
Inp [2159.00; 2159.00]   Show Hide
Inp 2159.00 NIST
Inp 2159.00 NIST
Tboil 618.84 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 [865.62; 948.07] J/mol×K [802.07; 1002.54] Show Hide
Cp,gas 865.62 J/mol×K 802.07 Joback Calculated Property
Cp,gas 882.28 J/mol×K 835.48 Joback Calculated Property
Cp,gas 897.71 J/mol×K 868.89 Joback Calculated Property
Cp,gas 911.97 J/mol×K 902.31 Joback Calculated Property
Cp,gas 925.08 J/mol×K 935.72 Joback Calculated Property
Cp,gas 937.10 J/mol×K 969.13 Joback Calculated Property
Cp,gas 948.07 J/mol×K 1002.54 Joback Calculated Property
η [0.0000342; 0.0008904] Pa×s [441.18; 802.07] Show Hide
η 0.0008904 Pa×s 441.18 Joback Calculated Property
η 0.0003734 Pa×s 501.33 Joback Calculated Property
η 0.0001886 Pa×s 561.48 Joback Calculated Property
η 0.0001087 Pa×s 621.62 Joback Calculated Property
η 0.0000691 Pa×s 681.77 Joback Calculated Property
η 0.0000472 Pa×s 741.92 Joback Calculated Property
η 0.0000342 Pa×s 802.07 Joback Calculated Property

Similar Compounds

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

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

Sources

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