Chemical Properties of Glutaric acid, 2-chloro-6-fluorophenyl phenethyl ester

Glutaric acid, 2-chloro-6-fluorophenyl phenethyl ester

InChI
InChI=1S/C19H18ClFO4/c20-15-8-4-9-16(21)19(15)25-18(23)11-5-10-17(22)24-13-12-14-6-2-1-3-7-14/h1-4,6-9H,5,10-13H2
InChI Key
OQPDHBVWRLORJN-UHFFFAOYSA-N
Formula
C19H18ClFO4
SMILES
O=C(CCCC(=O)Oc1c(F)cccc1Cl)OCCc1ccccc1
Molecular Weight1
364.80
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Physical Properties

Property Value Unit Source
ΔfusH° 48.28 kJ/mol Joback Calculated Property
ΔvapH° 112.79 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.341 Crippen Calculated Property
McVol 259.940 ml/mol McGowan Calculated Property
Inp [2608.00; 2608.00]   Show Hide
Inp 2608.00 NIST
Inp 2608.00 NIST
Tboil 648.03 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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 [353.41; 787.99] 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 A1.62050e+01
Coefficient B1.44100e+00
Coefficient C-7.85720e-04
Coefficient D1.16500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 353.41 J/mol×K 273.00 Calculated Property
Cp,gas 432.82 J/mol×K 353.78 Calculated Property
Cp,gas 503.59 J/mol×K 434.56 Calculated Property
Cp,gas 566.08 J/mol×K 515.33 Calculated Property
Cp,gas 620.67 J/mol×K 596.11 Calculated Property
Cp,gas 667.73 J/mol×K 676.89 Calculated Property
Cp,gas 707.62 J/mol×K 757.67 Calculated Property
Cp,gas 740.72 J/mol×K 838.44 Calculated Property
Cp,gas 767.38 J/mol×K 919.22 Calculated Property
Cp,gas 787.99 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 2-chloro-6-fluorophenyl phenethyl ester. Glutaric acid, 2,4,6-trichlorophenyl phenethyl ester. Glutaric acid, 2-fluorophenyl phenethyl ester. Glutaric acid, 2,3-dichlorophenyl phenethyl ester. Glutaric acid, 3-chlorophenyl phenethyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 3-phenylpropyl ester. Succinic acid, 2-fluorophenyl phenethyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 3-ethylphenyl ester. Succinic acid, phenethyl 2,3-dichlorophenyl ester. Succinic acid, 2,4,6-trichlorophenyl phenethyl ester. Fumaric acid, 2-phenethyl 2-chloro-6-fluorophenyl ester. Succinic acid, 2-chloro-6-fluorophenyl 3-phenylpropyl ester. Glutaric acid, 2,3-dichlorophenyl 3-phenylpropyl ester. Glutaric acid, naphth-2-ylmethyl 2-chloro-6-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 3-phenylpropyl ester.

Find more compounds similar to Glutaric acid, 2-chloro-6-fluorophenyl phenethyl ester.

Sources

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