Chemical Properties of Glutaric acid, (2-chlorocyclohexyl)methyl 1,1,1-trifluoroprop-2-yl ester

Glutaric acid, (2-chlorocyclohexyl)methyl 1,1,1-trifluoroprop-2-yl ester

InChI
InChI=1S/C15H22ClF3O4/c1-10(15(17,18)19)23-14(21)8-4-7-13(20)22-9-11-5-2-3-6-12(11)16/h10-12H,2-9H2,1H3
InChI Key
FKBWOLRFPJODQT-UHFFFAOYSA-N
Formula
C15H22ClF3O4
SMILES
CC(OC(=O)CCCC(=O)OCC1CCCCC1Cl)C(F)(F)F
Molecular Weight1
358.78
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° 38.75 kJ/mol Joback Calculated Property
logPoct/wat 3.991 Crippen Calculated Property
McVol 243.780 ml/mol McGowan Calculated Property
Inp [1930.00; 1930.00]   Show Hide
Inp 1930.00 NIST
Inp 1930.00 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 [356.74; 832.63] 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 A-1.45860e+01
Coefficient B1.58872e+00
Coefficient C-8.73200e-04
Coefficient D1.31700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 356.74 J/mol×K 273.00 Calculated Property
Cp,gas 444.01 J/mol×K 353.78 Calculated Property
Cp,gas 521.71 J/mol×K 434.56 Calculated Property
Cp,gas 590.26 J/mol×K 515.33 Calculated Property
Cp,gas 650.08 J/mol×K 596.11 Calculated Property
Cp,gas 701.56 J/mol×K 676.89 Calculated Property
Cp,gas 745.15 J/mol×K 757.67 Calculated Property
Cp,gas 781.24 J/mol×K 838.44 Calculated Property
Cp,gas 810.27 J/mol×K 919.22 Calculated Property
Cp,gas 832.63 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 1,1,1-trifluoroprop-2-yl (2-chlorocyclohexyl)methyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl but-3-yn-2-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2,2,3,3-tetrafluoropropyl ester. Glutaric acid, di((2-chlorocyclohexyl)methyl) ester. Glutaric acid, (2-chlorocyclohexyl)methyl cyclohexylmethyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl hept-2-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2-methylpent-3-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl dec-2-yl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2-ethylhexyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 8-chlorooctyl ester. Succinic acid, 2,2,3,3-tetrafluoropropyl (2-chlorocyclohexyl)methyl ester. Succinic acid, 3-methylbut-2-yl (2-chlorocyclohexyl)methyl ester. Succinic acid, dec-2-yl (2-chlorocyclohexyl)methyl ester. Succinic acid, hept-2-yl (2-chlorocyclohexyl)methyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 2,2-dichloroethyl ester.

Find more compounds similar to Glutaric acid, (2-chlorocyclohexyl)methyl 1,1,1-trifluoroprop-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.