Chemical Properties of Glutaric acid, 2-fluorophenyl 2-methylpentyl ester

Glutaric acid, 2-fluorophenyl 2-methylpentyl ester

InChI
InChI=1S/C17H23FO4/c1-3-7-13(2)12-21-16(19)10-6-11-17(20)22-15-9-5-4-8-14(15)18/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3
InChI Key
SUWKWXMUGMQQMO-UHFFFAOYSA-N
Formula
C17H23FO4
SMILES
CCCC(C)COC(=O)CCCC(=O)Oc1ccccc1F
Molecular Weight1
310.36
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Physical Properties

Property Value Unit Source
ΔfH°gas -982.75 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 41.73 kJ/mol Joback Calculated Property
ΔvapH° 90.61 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.881 Crippen Calculated Property
McVol 243.280 ml/mol McGowan Calculated Property
Inp [2093.00; 2093.00]   Show Hide
Inp 2093.00 NIST
Inp 2093.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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 [351.97; 798.64] 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 A2.30560e+01
Coefficient B1.38854e+00
Coefficient C-6.95560e-04
Coefficient D8.26000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 351.97 J/mol×K 273.00 Calculated Property
Cp,gas 430.89 J/mol×K 353.78 Calculated Property
Cp,gas 501.88 J/mol×K 434.56 Calculated Property
Cp,gas 565.20 J/mol×K 515.33 Calculated Property
Cp,gas 621.11 J/mol×K 596.11 Calculated Property
Cp,gas 669.87 J/mol×K 676.89 Calculated Property
Cp,gas 711.74 J/mol×K 757.67 Calculated Property
Cp,gas 746.98 J/mol×K 838.44 Calculated Property
Cp,gas 775.86 J/mol×K 919.22 Calculated Property
Cp,gas 798.64 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, 2-fluorophenyl 2-ethylhexyl ester. Glutaric acid, 2-fluorophenyl 2,4,4-trimethylpentyl ester. Glutaric acid, 2-fluorophenyl 2-ethylbutyl ester. Glutaric acid, 2-fluorophenyl 2-methylbutyl ester. Succinic acid, 2-fluorophenyl 2-methylpentyl ester. Glutaric acid, 2-fluorophenyl isohexyl ester. Glutaric acid, 2-fluorophenyl 3,7-dimethyloctyl ester. Glutaric acid, 2-fluorophenyl 3-methyl-5-methoxypentyl ester. Succinic acid, 2-fluorophenyl 2-ethylbutyl ester. Sebacic acid, 2-fluorophenyl isohexyl ester. Glutaric acid, cyclohexylmethyl 3-fluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-methylpentyl ester. Succinic acid, cyclohexylmethyl 2-fluorophenyl ester. Glutaric acid, 2-(cyclohexyl)ethyl 2-fluorophenyl ester. Succinic acid, 2-fluorophenyl 2,4,4-trimethylpentyl ester.

Find more compounds similar to Glutaric acid, 2-fluorophenyl 2-methylpentyl ester.

Sources

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