Chemical Properties of Diethylmalonic acid, 2-isopropoxyphenyl pentyl ester

Diethylmalonic acid, 2-isopropoxyphenyl pentyl ester

InChI
InChI=1S/C21H32O5/c1-6-9-12-15-24-19(22)21(7-2,8-3)20(23)26-18-14-11-10-13-17(18)25-16(4)5/h10-11,13-14,16H,6-9,12,15H2,1-5H3
InChI Key
IBRKJSDGTQWJAR-UHFFFAOYSA-N
Formula
C21H32O5
SMILES
CCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1OC(C)C
Molecular Weight1
364.48
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Physical Properties

Property Value Unit Source
ΔfusH° 42.79 kJ/mol Joback Calculated Property
log10WS -4.42 Relay (1.0) Calculated Property
logPoct/wat 4.919 Crippen Calculated Property
McVol 303.740 ml/mol McGowan Calculated Property
Pc 1190.70 kPa Joback Calculated Property
Inp 2243.00 NIST
Tboil 617.08 K Relay (1.0) Calculated Property
Tfus 304.91 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 [954.49; 1033.06] J/mol×K [846.93; 1050.02] Show Hide
Cp,gas 954.49 J/mol×K 846.93 Joback Calculated Property
Cp,gas 970.82 J/mol×K 880.78 Joback Calculated Property
Cp,gas 985.81 J/mol×K 914.63 Joback Calculated Property
Cp,gas 999.49 J/mol×K 948.47 Joback Calculated Property
Cp,gas 1011.91 J/mol×K 982.32 Joback Calculated Property
Cp,gas 1023.08 J/mol×K 1016.17 Joback Calculated Property
Cp,gas 1033.06 J/mol×K 1050.02 Joback Calculated Property
η [0.0000199; 0.0006139] Pa×s [459.68; 846.93] Show Hide
η 0.0006139 Pa×s 459.68 Joback Calculated Property
η 0.0002437 Pa×s 524.22 Joback Calculated Property
η 0.0001184 Pa×s 588.76 Joback Calculated Property
η 0.0000664 Pa×s 653.30 Joback Calculated Property
η 0.0000413 Pa×s 717.85 Joback Calculated Property
η 0.0000278 Pa×s 782.39 Joback Calculated Property
η 0.0000199 Pa×s 846.93 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, hexyl 2-isopropoxyphenyl ester. Diethylmalonic acid, heptyl 2-isopropoxyphenyl ester. Diethylmalonic acid, 2-isopropoxyphenyl pentadecyl ester. Diethylmalonic acid, hexadecyl 2-isopropoxyphenyl ester. Diethylmalonic acid, 2-isopropoxyphenyl nonyl ester. Diethylmalonic acid, heptadecyl 2-isopropoxyphenyl ester. Diethylmalonic acid, 2-isopropoxyphenyl tridecyl ester. Diethylmalonic acid, dodecyl 2-isopropoxyphenyl ester. Diethylmalonic acid, 2-isopropoxyphenyl tetradecyl ester. Diethylmalonic acid, 2-isopropoxyphenyl octyl ester. Diethylmalonic acid, butyl 2-isopropoxyphenyl ester. Diethylmalonic acid, isobutyl 2-isopropoxyphenyl ester. Diethylmalonic acid, decyl 2,6-dimethoxyphenyl ester. Diethylmalonic acid, 2,6-dimethoxyphenyl nonyl ester. Diethylmalonic acid, 2,6-dimethoxyphenyl heptyl ester.

Find more compounds similar to Diethylmalonic acid, 2-isopropoxyphenyl pentyl ester.

Sources

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