Chemical Properties of Fumaric acid, 2-isopropoxyphenyl 2-ethylhexyl ester

Fumaric acid, 2-isopropoxyphenyl 2-ethylhexyl ester

InChI
InChI=1S/C21H30O5/c1-5-7-10-17(6-2)15-24-20(22)13-14-21(23)26-19-12-9-8-11-18(19)25-16(3)4/h8-9,11-14,16-17H,5-7,10,15H2,1-4H3/b14-13+
InChI Key
RFGZZRQREVSUHI-BUHFOSPRSA-N
Formula
C21H30O5
SMILES
CCCCC(CC)COC(=O)C=CC(=O)Oc1ccccc1OC(C)C
Molecular Weight1
362.46
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Physical Properties

Property Value Unit Source
ΔfusH° 46.88 kJ/mol Joback Calculated Property
log10WS -5.21 Relay (1.0) Calculated Property
logPoct/wat 4.695 Crippen Calculated Property
McVol 299.440 ml/mol McGowan Calculated Property
Pc 1225.12 kPa Joback Calculated Property
Inp [2437.00; 2437.00]   Show Hide
Inp 2437.00 NIST
Inp 2437.00 NIST
Tboil 628.86 K Relay (1.0) Calculated Property
Tfus 283.14 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 [927.51; 1003.44] J/mol×K [853.88; 1057.98] Show Hide
Cp,gas 927.51 J/mol×K 853.88 Joback Calculated Property
Cp,gas 943.32 J/mol×K 887.90 Joback Calculated Property
Cp,gas 957.84 J/mol×K 921.91 Joback Calculated Property
Cp,gas 971.08 J/mol×K 955.93 Joback Calculated Property
Cp,gas 983.07 J/mol×K 989.95 Joback Calculated Property
Cp,gas 993.85 J/mol×K 1023.96 Joback Calculated Property
Cp,gas 1003.44 J/mol×K 1057.98 Joback Calculated Property
η [0.0000201; 0.0007326] Pa×s [437.18; 853.88] Show Hide
η 0.0007326 Pa×s 437.18 Joback Calculated Property
η 0.0002666 Pa×s 506.63 Joback Calculated Property
η 0.0001238 Pa×s 576.08 Joback Calculated Property
η 0.0000678 Pa×s 645.53 Joback Calculated Property
η 0.0000418 Pa×s 714.98 Joback Calculated Property
η 0.0000280 Pa×s 784.43 Joback Calculated Property
η 0.0000201 Pa×s 853.88 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-methoxyphenyl 2-ethylhexyl ester. Fumaric acid, 2-methoxyphenyl cyclohexylmethyl ester. Fumaric acid, 2,6-dimethoxyphenyl 2-ethylhexyl ester. Fumaric acid, 2,6-dimethoxyphenyl cyclohexylmethyl ester. Fumaric acid, 2-isopropoxyphenyl hept-2-yl ester. Fumaric acid, 2-isopropoxyphenyl 8-chlorooctyl ester. Fumaric acid, 4-methoxyphenyl 2-ethylhexyl ester. Fumaric acid, naphth-1-yl 2-ethylhexyl ester. Fumaric acid, 2-isopropoxyphenyl 2-methylpent-3-yl ester. Fumaric acid, 2-chlorophenyl 2-ethylhexyl ester. Fumaric acid, naphth-2-yl 2-ethylhexyl ester. Fumaric acid, 2-ethylhexyl 2-fluorophenyl ester. Fumaric acid, 3-chlorophenyl 2-ethylhexyl ester. Succinic acid, cyclohexylmethyl 2-isopropoxyphenyl ester. Fumaric acid, 2,4-dichlorophenyl 2-ethylhexyl ester.

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

Sources

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