Chemical Properties of Succinic acid, but-3-yn-2-yl 3,5-dichlorophenyl ester

Succinic acid, but-3-yn-2-yl 3,5-dichlorophenyl ester

InChI
InChI=1S/C14H12Cl2O4/c1-3-9(2)19-13(17)4-5-14(18)20-12-7-10(15)6-11(16)8-12/h1,6-9H,4-5H2,2H3
InChI Key
VGEYTAIYMLOLHR-UHFFFAOYSA-N
Formula
C14H12Cl2O4
SMILES
C#CC(C)OC(=O)CCC(=O)Oc1cc(Cl)cc(Cl)c1
Molecular Weight1
315.15
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Physical Properties

Property Value Unit Source
ΔfusH° 41.86 kJ/mol Joback Calculated Property
log10WS -4.63 Relay (1.0) Calculated Property
logPoct/wat 3.244 Crippen Calculated Property
McVol 215.120 ml/mol McGowan Calculated Property
Inp [2094.00; 2094.00]   Show Hide
Inp 2094.00 NIST
Inp 2094.00 NIST
Tfus 336.54 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 [298.31; 592.61] 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 A7.35520e+01
Coefficient B9.51920e-01
Coefficient C-4.85650e-04
Coefficient D5.27900e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 298.31 J/mol×K 273.00 Calculated Property
Cp,gas 351.87 J/mol×K 353.78 Calculated Property
Cp,gas 399.84 J/mol×K 434.56 Calculated Property
Cp,gas 442.36 J/mol×K 515.33 Calculated Property
Cp,gas 479.61 J/mol×K 596.11 Calculated Property
Cp,gas 511.75 J/mol×K 676.89 Calculated Property
Cp,gas 538.96 J/mol×K 757.67 Calculated Property
Cp,gas 561.39 J/mol×K 838.44 Calculated Property
Cp,gas 579.22 J/mol×K 919.22 Calculated Property
Cp,gas 592.61 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, but-3-yn-2-yl 3-chlorophenyl ester. Succinic acid, but-3-yn-2-yl 2-chlorophenyl ester. Succinic acid, but-3-yn-2-yl 2,4,5-trichlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3,5-dichlorophenyl ester. Succinic acid, hex-4-yn-3-yl 3,5-dichlorophenyl ester. Succinic acid, but-3-yn-2-yl 2,4,6-trichlorophenyl ester. Succinic acid, 3,5-dichlorophenyl ethyl ester. Glutaric acid, but-3-yn-2-yl 3-chlorophenyl ester. Glutaric acid, but-3-yn-2-yl 2,3,5-trichlorophenyl ester. Succinic acid, 3,5-dichlorophenyl propyl ester. Succinic acid, but-3-yn-2-yl 4-chloro-2-methoxyphenyl ester. Glutaric acid, 2,3-dichlorophenyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl 2,5-dichlorophenyl ester. Succinic acid, but-3-yn-2-yl 4-bromophenyl ester. Glutaric acid, but-3-yn-2-yl 2,4-dichlorophenyl ester.

Find more compounds similar to Succinic acid, but-3-yn-2-yl 3,5-dichlorophenyl ester.

Sources

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