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

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

InChI
InChI=1S/C18H24O5/c1-13(2)11-12-21-17(19)9-10-18(20)23-16-8-6-5-7-15(16)22-14(3)4/h5-8,11,14H,9-10,12H2,1-4H3
InChI Key
PQBMVRLCQWQQAB-UHFFFAOYSA-N
Formula
C18H24O5
SMILES
CC(C)=CCOC(=O)CCC(=O)Oc1ccccc1OC(C)C
Molecular Weight1
320.38
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Physical Properties

Property Value Unit Source
ΔfusH° 41.32 kJ/mol Joback Calculated Property
log10WS -3.75 Relay (1.0) Calculated Property
logPoct/wat 3.669 Crippen Calculated Property
McVol 257.170 ml/mol McGowan Calculated Property
Inp [2239.00; 2239.00]   Show Hide
Inp 2239.00 NIST
Inp 2239.00 NIST
Tfus 315.97 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [366.54; 830.80] 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 A2.76830e+01
Coefficient B1.42848e+00
Coefficient C-7.08660e-04
Coefficient D8.33000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 366.54 J/mol×K 273.00 Calculated Property
Cp,gas 448.04 J/mol×K 353.78 Calculated Property
Cp,gas 521.45 J/mol×K 434.56 Calculated Property
Cp,gas 587.03 J/mol×K 515.33 Calculated Property
Cp,gas 645.04 J/mol×K 596.11 Calculated Property
Cp,gas 695.75 J/mol×K 676.89 Calculated Property
Cp,gas 739.41 J/mol×K 757.67 Calculated Property
Cp,gas 776.30 J/mol×K 838.44 Calculated Property
Cp,gas 806.68 J/mol×K 919.22 Calculated Property
Cp,gas 830.80 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 3-methylbut-2-en-1-yl 2-methoxyphenyl ester. Glutaric 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 4-fluoro-2-methoxyphenyl ester. Succinic acid, 2,2-dichloroethyl 2-isopropoxyphenyl ester. Succinic acid, 2-isopropoxyphenyl 2-chloroethyl ester. Succinic acid, 3-methylbut-2-en-1-yl 4-bromo-2-methoxyphenyl ester. Succinic acid, 2-isopropoxyphenyl 2-ethoxyethyl ester. Succinic acid, 3-methylbut-2-en-1-yl 2-methoxy-5-methylphenyl ester. Succinic acid, 2-isopropoxyphenyl 2-methoxyethyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-methoxyphenyl ester. Succinic acid, 2-isopropoxyphenyl 2-(dimethylamino)ethyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 4-chloro-2-methoxyphenyl ester. Succinic acid, but-3-yn-2-yl 2-isopropoxyphenyl ester. Glutaric acid, ethyl 2-isopropoxyphenyl ester.

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

Sources

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