Chemical Properties of Succinic acid, hex-4-yn-3-yl 2-naphthyl ester

Succinic acid, hex-4-yn-3-yl 2-naphthyl ester

InChI
InChI=1S/C20H20O4/c1-3-7-17(4-2)23-19(21)12-13-20(22)24-18-11-10-15-8-5-6-9-16(15)14-18/h5-6,8-11,14,17H,4,12-13H2,1-2H3
InChI Key
CHSFISYWMDEMKO-UHFFFAOYSA-N
Formula
C20H20O4
SMILES
CC#CC(CC)OC(=O)CCC(=O)Oc1ccc2ccccc2c1
Molecular Weight1
324.37
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Physical Properties

Property Value Unit Source
ΔfusH° 46.56 kJ/mol Joback Calculated Property
logPoct/wat 3.870 Crippen Calculated Property
McVol 255.720 ml/mol McGowan Calculated Property
Inp [2671.00; 2671.00]   Show Hide
Inp 2671.00 NIST
Inp 2671.00 NIST
Tboil 668.29 K Relay (1.0) Calculated Property
Tfus 359.78 K Relay (1.0) Calculated Property

Cheméo can also estimate 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, 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 [349.52; 794.43] 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 A3.53000e-01
Coefficient B1.50824e+00
Coefficient C-8.86940e-04
Coefficient D1.72780e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 349.52 J/mol×K 273.00 Calculated Property
Cp,gas 430.58 J/mol×K 353.78 Calculated Property
Cp,gas 502.46 J/mol×K 434.56 Calculated Property
Cp,gas 565.70 J/mol×K 515.33 Calculated Property
Cp,gas 620.86 J/mol×K 596.11 Calculated Property
Cp,gas 668.47 J/mol×K 676.89 Calculated Property
Cp,gas 709.09 J/mol×K 757.67 Calculated Property
Cp,gas 743.26 J/mol×K 838.44 Calculated Property
Cp,gas 771.52 J/mol×K 919.22 Calculated Property
Cp,gas 794.43 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, hex-4-yn-3-yl 3-methoxyphenyl ester. Glutaric acid, hex-4-yn-3-yl 1-naphthyl ester. Succinic acid, hex-4-yn-3-yl 4-bromophenyl ester. Succinic acid, hex-4-yn-3-yl 3-fluorophenyl ester. Succinic acid, hex-4-yn-3-yl 3,5-dichlorophenyl ester. Succinic acid, hex-4-yn-3-yl 2-fluorophenyl ester. Succinic acid, hex-4-yn-3-yl 4-biphenyl ester. Glutaric acid, hex-4-yn-3-yl 3-chlorophenyl ester. Succinic acid, hex-4-yn-3-yl 3-nitrophenyl ester. Succinic acid, hex-4-yn-3-yl 2-isopropoxyphenyl ester. Succinic acid, hex-4-yn-3-yl 2,4,5-trichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 4-bromophenyl ester. Succinic acid, hex-4-yn-3-yl 4-chloro-2-methoxyphenyl ester. Succinic acid, hept-2-yl 2-naphthyl ester. Succinic acid, dec-2-yl 2-naphthyl ester.

Find more compounds similar to Succinic acid, hex-4-yn-3-yl 2-naphthyl ester.

Sources

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