Chemical Properties of 1,1,3-Trichlorotrifluoroacetone

1,1,3-Trichlorotrifluoroacetone

InChI
InChI=1S/C3Cl3F3O/c4-2(5,7)1(10)3(6,8)9
InChI Key
QCVAFEQJWDOJLG-UHFFFAOYSA-N
Formula
C3Cl3F3O
SMILES
O=C(C(F)(F)Cl)C(F)(Cl)Cl
Molecular Weight1
215.38
Other Names
  • 1,1,3-Trichloro-1,3,3-trifluoro-2-propanone
  • 1,1,3-Trichloro-1,3,3-trifluoroacetone
  • 1,1,3-Trifluoro-1,3,3-trichloroacetone
  • 2-Propanone, 1,1,3-trichloro-1,3,3-trifluoro-
  • 3FK
  • Acetone, 1,1,3-trichloro-1,3,3-trifluoro-
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
ω 0.2668 Relay (1.0) Calculated Property
ΔfusH° 12.13 kJ/mol Joback Calculated Property
IE 11.21 ± 0.02 eV NIST
logPoct/wat 2.488 Crippen Calculated Property
McVol 96.730 ml/mol McGowan Calculated Property
Pc 3668.65 kPa Joback Calculated Property
Tboil 351.38 K Relay (1.0) Calculated Property
Tc 540.02 K Relay (1.0) Calculated Property
Tfus 167.11 K Relay (1.0) Calculated Property
Vc 0.362 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, 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 [131.94; 212.08] 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 A1.55200e+01
Coefficient B5.68200e-01
Coefficient C-5.74700e-04
Coefficient D2.03060e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 131.94 J/mol×K 273.00 Calculated Property
Cp,gas 153.60 J/mol×K 353.78 Calculated Property
Cp,gas 170.57 J/mol×K 434.56 Calculated Property
Cp,gas 183.50 J/mol×K 515.33 Calculated Property
Cp,gas 193.03 J/mol×K 596.11 Calculated Property
Cp,gas 199.79 J/mol×K 676.89 Calculated Property
Cp,gas 204.43 J/mol×K 757.67 Calculated Property
Cp,gas 207.60 J/mol×K 838.44 Calculated Property
Cp,gas 209.94 J/mol×K 919.22 Calculated Property
Cp,gas 212.08 J/mol×K 1000.00 Calculated Property

Similar Compounds

1,3-Dichlorotetrafluoroacetone. 1-chloro-1,1,3,3,3-pentafluoropropan-2-one. Propane, 1,1,3-trichloro-1,2,2,3,3-pentafluoro-. Propane, 1,2,2,3-tetrachloro-1,1,3,3-tetrafluoro-. Propane, 1,1,1,2,2,3-hexachloro-3,3-difluoro-. Propane, 1,2,3-trichloro-1,1,2,3,3-pentafluoro-. 1,1,1,3-tetrachlorotetrafluoropropane. 2-Propanone, 1,1,1,3,3,3-hexachloro-. 2-Propanone, 1,1,1,3,3,3-hexafluoro-. Propane, 1,2,2,3,3-pentachloro-1,1-difluoro-. Propane, 1,2,2-trichloro-1,1,3,3,3-pentafluoro-. 2-Propanone, 1,1,1,3,3-pentafluoro-. 1,2-Dichloro-1,1,2,3,3,3-hexafluoropropane. 2-Propanone, 1,1,1,3,3-pentachloro-. 2-Propanone, 1,1,3,3-tetrachloro-.

Find more compounds similar to 1,1,3-Trichlorotrifluoroacetone.

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.