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

Succinic acid, hex-4-yn-3-yl 4-biphenyl ester

InChI
InChI=1S/C22H22O4/c1-3-8-19(4-2)25-21(23)15-16-22(24)26-20-13-11-18(12-14-20)17-9-6-5-7-10-17/h5-7,9-14,19H,4,15-16H2,1-2H3
InChI Key
YNNYSZLVZDGNEV-UHFFFAOYSA-N
Formula
C22H22O4
SMILES
CC#CC(CC)OC(=O)CCC(=O)Oc1ccc(-c2ccccc2)cc1
Molecular Weight1
350.41
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Physical Properties

Property Value Unit Source
ΔfusH° 48.77 kJ/mol Joback Calculated Property
logPoct/wat 4.384 Crippen Calculated Property
McVol 279.600 ml/mol McGowan Calculated Property
Inp [2885.00; 2885.00]   Show Hide
Inp 2885.00 NIST
Inp 2885.00 NIST
Tboil 679.17 K Relay (1.0) Calculated Property
Tfus 375.70 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 [375.68; 869.87] 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 A-3.92700e+00
Coefficient B1.62304e+00
Coefficient C-8.90220e-04
Coefficient D1.40980e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 375.68 J/mol×K 273.00 Calculated Property
Cp,gas 465.09 J/mol×K 353.78 Calculated Property
Cp,gas 544.84 J/mol×K 434.56 Calculated Property
Cp,gas 615.36 J/mol×K 515.33 Calculated Property
Cp,gas 677.11 J/mol×K 596.11 Calculated Property
Cp,gas 730.53 J/mol×K 676.89 Calculated Property
Cp,gas 776.08 J/mol×K 757.67 Calculated Property
Cp,gas 814.18 J/mol×K 838.44 Calculated Property
Cp,gas 845.30 J/mol×K 919.22 Calculated Property
Cp,gas 869.87 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, hex-4-yn-3-yl 4-biphenyl ester. Succinic acid, hex-4-yn-3-yl 4-bromophenyl ester. Succinic acid, hex-4-yn-3-yl 3-methoxyphenyl ester. Succinic acid, hex-4-yn-3-yl 2-naphthyl ester. Succinic acid, but-3-yn-2-yl 4-biphenyl ester. Glutaric acid, hex-4-yn-3-yl 4-bromophenyl ester. Succinic acid, hept-2-yl 4-biphenyl ester. Succinic acid, dec-2-yl 4-biphenyl ester. Succinic acid, 2-methylpent-3-yl 4-biphenyl ester. Succinic acid, hex-4-yn-3-yl 3-fluorophenyl ester. Succinic acid, 3-methylbut-2-yl 4-biphenyl ester. Succinic acid, hex-4-yn-3-yl 4-bromo-2-methoxyphenyl ester. Glutaric acid, but-3-yn-2-yl 4-biphenyl ester. Succinic acid, hex-4-yn-3-yl 3-nitrophenyl ester. Glutaric acid, hex-4-yn-3-yl 3-methylphenyl ester.

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

Sources

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