Chemical Properties of Fumaric acid, 2-isopropoxyphenyl hept-2-yl ester

Fumaric acid, 2-isopropoxyphenyl hept-2-yl ester

InChI
InChI=1S/C20H28O5/c1-5-6-7-10-16(4)24-19(21)13-14-20(22)25-18-12-9-8-11-17(18)23-15(2)3/h8-9,11-16H,5-7,10H2,1-4H3/b14-13+
InChI Key
KVHCXKYCRMNSSY-BUHFOSPRSA-N
Formula
C20H28O5
SMILES
CCCCCC(C)OC(=O)C=CC(=O)Oc1ccccc1OC(C)C
Molecular Weight1
348.43
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Physical Properties

Property Value Unit Source
ΔfusH° 44.29 kJ/mol Joback Calculated Property
log10WS -4.81 Relay (1.0) Calculated Property
logPoct/wat 4.447 Crippen Calculated Property
McVol 285.350 ml/mol McGowan Calculated Property
Inp [2318.00; 2318.00]   Show Hide
Inp 2318.00 NIST
Inp 2318.00 NIST
Tfus 306.57 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, 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 [868.83; 944.72] J/mol×K [831.00; 1034.87] Show Hide
Cp,gas 868.83 J/mol×K 831.00 Joback Calculated Property
Cp,gas 884.55 J/mol×K 864.98 Joback Calculated Property
Cp,gas 899.01 J/mol×K 898.96 Joback Calculated Property
Cp,gas 912.23 J/mol×K 932.93 Joback Calculated Property
Cp,gas 924.24 J/mol×K 966.91 Joback Calculated Property
Cp,gas 935.06 J/mol×K 1000.89 Joback Calculated Property
Cp,gas 944.72 J/mol×K 1034.87 Joback Calculated Property
η [0.0000233; 0.0008372] Pa×s [425.91; 831.00] Show Hide
η 0.0008372 Pa×s 425.91 Joback Calculated Property
η 0.0003064 Pa×s 493.43 Joback Calculated Property
η 0.0001428 Pa×s 560.94 Joback Calculated Property
η 0.0000784 Pa×s 628.46 Joback Calculated Property
η 0.0000484 Pa×s 695.97 Joback Calculated Property
η 0.0000325 Pa×s 763.49 Joback Calculated Property
η 0.0000233 Pa×s 831.00 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-methoxyphenyl hept-2-yl ester. Fumaric acid, 2,6-dimethoxyphenyl dec-2-yl ester. Fumaric acid, 2,6-dimethoxyphenyl hept-2-yl ester. Fumaric acid, 2-isopropoxyphenyl 8-chlorooctyl ester. Fumaric acid, 2-isopropoxyphenyl 2-ethylhexyl ester. Fumaric acid, 2-isopropoxyphenyl 2-methylpent-3-yl ester. Fumaric acid, 2-isopropoxyphenyl 3-methylbut-2-yl ester. Glutaric acid, hept-2-yl 2-isopropoxyphenyl ester. Glutaric acid, dec-2-yl 2-isopropoxyphenyl ester. Fumaric acid, 4-methoxyphenyl hept-2-yl ester. Fumaric acid, 2-methoxyphenyl 2-methylpent-3-yl ester. Fumaric acid, 2-methoxyphenyl 2-ethylhexyl ester. Fumaric acid, 2-methoxyphenyl 8-chlorooctyl ester. Fumaric acid, 2,6-dimethoxyphenyl 2-methylpent-3-yl ester. Fumaric acid, naphth-1-yl dec-2-yl ester.

Find more compounds similar to Fumaric acid, 2-isopropoxyphenyl hept-2-yl ester.

Sources

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