Chemical Properties of Glutaric acid, 2-fluorophenyl 4-methylpent-2-yl ester

Glutaric acid, 2-fluorophenyl 4-methylpent-2-yl ester

InChI
InChI=1S/C17H23FO4/c1-12(2)11-13(3)21-16(19)9-6-10-17(20)22-15-8-5-4-7-14(15)18/h4-5,7-8,12-13H,6,9-11H2,1-3H3
InChI Key
IYSAPCYDTDPTEU-UHFFFAOYSA-N
Formula
C17H23FO4
SMILES
CC(C)CC(C)OC(=O)CCCC(=O)Oc1ccccc1F
Molecular Weight1
310.36
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 38.21 kJ/mol Joback Calculated Property
logPoct/wat 3.879 Crippen Calculated Property
McVol 243.280 ml/mol McGowan Calculated Property
Inp [1995.00; 1995.00]   Show Hide
Inp 1995.00 NIST
Inp 1995.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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 [351.65; 799.17] 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 A2.13740e+01
Coefficient B1.39446e+00
Coefficient C-6.98760e-04
Coefficient D8.21000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 351.65 J/mol×K 273.00 Calculated Property
Cp,gas 430.88 J/mol×K 353.78 Calculated Property
Cp,gas 502.13 J/mol×K 434.56 Calculated Property
Cp,gas 565.65 J/mol×K 515.33 Calculated Property
Cp,gas 621.71 J/mol×K 596.11 Calculated Property
Cp,gas 670.57 J/mol×K 676.89 Calculated Property
Cp,gas 712.49 J/mol×K 757.67 Calculated Property
Cp,gas 747.72 J/mol×K 838.44 Calculated Property
Cp,gas 776.53 J/mol×K 919.22 Calculated Property
Cp,gas 799.17 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, 2-fluorophenyl 2-pentyl ester. Glutaric acid, 2-fluorophenyl 2-methylhex-3-yl ester. Succinic acid, 2-fluorophenyl 4-methylpent-2-yl ester. Glutaric acid, 2-fluorophenyl 2,4-dimethylpent-3-yl ester. Glutaric acid, 2-chloro-6-fluorophenyl 4-methylpent-2-yl ester. Glutaric acid, 2-fluorophenyl 2-hexyl ester. Glutaric acid, cyclopentyl 2-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 2-octyl ester. Glutaric acid, 2-fluorophenyl 2-heptyl ester. Glutaric acid, 2-fluorophenyl cis-4-tert-butylcyclohexyl ester. Glutaric acid, 2-fluorophenyl hept-4-yl ester. Glutaric acid, 2-fluorophenyl 3-hexyl ester. Glutaric acid, 2-fluorophenyl 3-methylbut-2-yl ester. Glutaric acid, 2-norbornyl 2-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 3-octyl ester.

Find more compounds similar to Glutaric acid, 2-fluorophenyl 4-methylpent-2-yl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.