Chemical Properties of Diethylmalonic acid, heptyl 3-methylphenyl ester

Diethylmalonic acid, heptyl 3-methylphenyl ester

InChI
InChI=1S/C21H32O4/c1-5-8-9-10-11-15-24-19(22)21(6-2,7-3)20(23)25-18-14-12-13-17(4)16-18/h12-14,16H,5-11,15H2,1-4H3
InChI Key
FDOZORHBKZWCSO-UHFFFAOYSA-N
Formula
C21H32O4
SMILES
CCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1cccc(C)c1
Molecular Weight1
348.48
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Physical Properties

Property Value Unit Source
ΔfusH° 45.12 kJ/mol Joback Calculated Property
IE 8.28 eV Relay (1.0) Calculated Property
log10WS -5.45 Relay (1.0) Calculated Property
logPoct/wat 5.220 Crippen Calculated Property
McVol 297.870 ml/mol McGowan Calculated Property
Pc 1198.13 kPa Joback Calculated Property
Inp 2237.00 NIST
Tboil 630.04 K Relay (1.0) Calculated Property
Tfus 299.17 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 [924.28; 1007.09] J/mol×K [824.95; 1025.33] Show Hide
Cp,gas 924.28 J/mol×K 824.95 Joback Calculated Property
Cp,gas 941.05 J/mol×K 858.35 Joback Calculated Property
Cp,gas 956.57 J/mol×K 891.74 Joback Calculated Property
Cp,gas 970.89 J/mol×K 925.14 Joback Calculated Property
Cp,gas 984.06 J/mol×K 958.53 Joback Calculated Property
Cp,gas 996.11 J/mol×K 991.93 Joback Calculated Property
Cp,gas 1007.09 J/mol×K 1025.33 Joback Calculated Property
η [0.0000293; 0.0007817] Pa×s [452.45; 824.95] Show Hide
η 0.0007817 Pa×s 452.45 Joback Calculated Property
η 0.0003251 Pa×s 514.53 Joback Calculated Property
η 0.0001633 Pa×s 576.62 Joback Calculated Property
η 0.0000938 Pa×s 638.70 Joback Calculated Property
η 0.0000594 Pa×s 700.78 Joback Calculated Property
η 0.0000406 Pa×s 762.87 Joback Calculated Property
η 0.0000293 Pa×s 824.95 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, dodecyl 3-methylphenyl ester. Diethylmalonic acid, hexadecyl 3-methylphenyl ester. Diethylmalonic acid, 3-methylphenyl tridecyl ester. Diethylmalonic acid, 3-methylphenyl octyl ester. Diethylmalonic acid, 3-methylphenyl tetradecyl ester. Diethylmalonic acid, 3-methylphenyl undecyl ester. Diethylmalonic acid, 3-methylphenyl pentadecyl ester. Diethylmalonic acid, heptadecyl 3-methylphenyl ester. Diethylmalonic acid, hexyl 3-methylphenyl ester. Diethylmalonic acid, decyl 3-methylphenyl ester. Diethylmalonic acid, 3-methylphenyl nonyl ester. Diethylmalonic acid, 3-methylphenyl octadecyl ester. Diethylmalonic acid, pentyl 3-methylphenyl ester. Diethylmalonic acid, butyl 3-methylphenyl ester. Diethylmalonic acid, 3-methylphenyl propyl ester.

Find more compounds similar to Diethylmalonic acid, heptyl 3-methylphenyl ester.

Sources

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