Chemical Properties of Succinic acid, 3-methylbut-2-en-1-yl 3-methoxyphenyl ester

Succinic acid, 3-methylbut-2-en-1-yl 3-methoxyphenyl ester

InChI
InChI=1S/C16H20O5/c1-12(2)9-10-20-15(17)7-8-16(18)21-14-6-4-5-13(11-14)19-3/h4-6,9,11H,7-8,10H2,1-3H3
InChI Key
GWVVYEBKTHTTMW-UHFFFAOYSA-N
Formula
C16H20O5
SMILES
COc1cccc(OC(=O)CCC(=O)OCC=C(C)C)c1
Molecular Weight1
292.33
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Physical Properties

Property Value Unit Source
ΔfusH° 39.67 kJ/mol Joback Calculated Property
ΔvapH° 94.29 kJ/mol Relay (1.0) Calculated Property
IE 8.13 eV Relay (1.0) Calculated Property
logPoct/wat 2.890 Crippen Calculated Property
McVol 228.990 ml/mol McGowan Calculated Property
Inp [2234.00; 2234.00]   Show Hide
Inp 2234.00 NIST
Inp 2234.00 NIST
Tboil 620.96 K Relay (1.0) Calculated Property
Tfus 307.28 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [324.42; 727.08] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.11830e+01
Coefficient B1.23256e+00
Coefficient C-5.96660e-04
Coefficient D6.00000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 324.42 J/mol×K 273.00 Calculated Property
Cp,gas 395.21 J/mol×K 353.78 Calculated Property
Cp,gas 459.05 J/mol×K 434.56 Calculated Property
Cp,gas 516.12 J/mol×K 515.33 Calculated Property
Cp,gas 566.61 J/mol×K 596.11 Calculated Property
Cp,gas 610.72 J/mol×K 676.89 Calculated Property
Cp,gas 648.63 J/mol×K 757.67 Calculated Property
Cp,gas 680.54 J/mol×K 838.44 Calculated Property
Cp,gas 706.62 J/mol×K 919.22 Calculated Property
Cp,gas 727.08 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 3-methylbut-2-en-1-yl 2-methoxyphenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 3-chlorophenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 3-fluorophenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 2-chlorophenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 2-isopropoxyphenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 4-chloro-2-methoxyphenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 2-fluorophenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 4-bromo-2-methoxyphenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 3,5-dichlorophenyl ester. Succinic acid, dodec-2-en-1-yl 3-methoxyphenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 4-fluoro-2-methoxyphenyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-methoxyphenyl ester. Succinic acid, 2,2-dichloroethyl 3-methoxyphenyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 4-bromophenyl ester. Succinic acid, 3-methylbut-2-en-1-yl 2-methoxy-5-methylphenyl ester.

Find more compounds similar to Succinic acid, 3-methylbut-2-en-1-yl 3-methoxyphenyl ester.

Sources

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