Chemical Properties of Glutaric acid, di(2-chloro-6-fluorophenyl) ester

Glutaric acid, di(2-chloro-6-fluorophenyl) ester

InChI
InChI=1S/C17H12Cl2F2O4/c18-10-4-1-6-12(20)16(10)24-14(22)8-3-9-15(23)25-17-11(19)5-2-7-13(17)21/h1-2,4-7H,3,8-9H2
InChI Key
INVHZKBJVAZCKA-UHFFFAOYSA-N
Formula
C17H12Cl2F2O4
SMILES
O=C(CCCC(=O)Oc1c(F)cccc1Cl)Oc1c(F)cccc1Cl
Molecular Weight1
389.18
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° 49.60 kJ/mol Joback Calculated Property
IE 8.65 eV Relay (1.0) Calculated Property
logPoct/wat 4.953 Crippen Calculated Property
McVol 245.770 ml/mol McGowan Calculated Property
Inp [2560.00; 2560.00]   Show Hide
Inp 2560.00 NIST
Inp 2560.00 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, 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 [337.69; 694.06] 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 A6.56030e+01
Coefficient B1.15060e+00
Coefficient C-5.79640e-04
Coefficient D5.75000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 337.69 J/mol×K 273.00 Calculated Property
Cp,gas 402.66 J/mol×K 353.78 Calculated Property
Cp,gas 460.86 J/mol×K 434.56 Calculated Property
Cp,gas 512.48 J/mol×K 515.33 Calculated Property
Cp,gas 557.69 J/mol×K 596.11 Calculated Property
Cp,gas 596.69 J/mol×K 676.89 Calculated Property
Cp,gas 629.64 J/mol×K 757.67 Calculated Property
Cp,gas 656.73 J/mol×K 838.44 Calculated Property
Cp,gas 678.14 J/mol×K 919.22 Calculated Property
Cp,gas 694.06 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, 2-chloro-6-fluorophenyl 2,6-dichlorophenyl ester. Glutaric acid, 2,4,6-trichlorophenyl 2-chloro-6-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 2-chloro-6-fluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl pentachlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl pentafluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2,4-dichlorophenyl ester. Glutaric acid, 3-chlorophenyl 2-chloro-6-fluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 3-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 2,6-dichlorophenyl ester. Glutaric acid, 2,3-dichlorophenyl 2-chloro-6-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 2,4-dichlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2,4,5-trichlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2,3,4-trifluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2,3,5-trichlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl isopropyl ester.

Find more compounds similar to Glutaric acid, di(2-chloro-6-fluorophenyl) 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.
These property values are available through the Cheméo API. A free account gives you an access key.