- InChI
- InChI=1S/CClF3/c2-1(3,4)5
- InChI Key
- AFYPFACVUDMOHA-UHFFFAOYSA-N
- Formula
- CClF3
- SMILES
- FC(F)(F)Cl
- Molecular Weight1
- 104.46
- CAS
- 75-72-9
- Other Names
-
- Arcton 3
- CClF3
- CF3Cl
- CFC-13
- Chlorotrifluromethane
- F 13
- FC 13
- Freon 13
- Frigen 13
- Genetron 13
- Halocarbon 13
- Halocarbon 13/ucon 13
- Khladon 13
- Methane, chlorotrifluoro-
- Monochlorotrifluoromethane
- R 13
- Refrigerant 13
- Trifluorochloromethane
- Trifluoromethyl chloride
- Trifluoromonochlorocarbon
- UN 1022
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- ρc : Critical density (kg/m3).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 571.30 | kJ/mol | NIST |
| BasG | 541.50 | kJ/mol | NIST |
| ΔfG° | -635.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | [-739.50; -695.40] | kJ/mol |
|
| ΔfH°gas | -708.80 ± 4.20 | kJ/mol | NIST |
| ΔfH°gas | -705.00 ± 3.40 | kJ/mol | NIST |
| ΔfH°gas | Outlier -739.50 ± 5.00 | kJ/mol | NIST |
| ΔfH°gas | -695.40 ± 9.20 | kJ/mol | NIST |
| ΔfH°gas | -699.00 | kJ/mol | NIST |
| ΔfH°gas | -715.00 ± 4.00 | kJ/mol | NIST |
| ΔfusH° | 4.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 18.46 | kJ/mol | Joback Calculated Property |
| IE | [12.39; 13.10] | eV |
|
| IE | 12.60 ± 0.40 | eV | NIST |
| IE | 13.00 ± 1.00 | eV | NIST |
| IE | 13.08 ± 0.02 | eV | NIST |
| IE | 12.60 ± 0.02 | eV | NIST |
| IE | 12.45 | eV | NIST |
| IE | 12.39 | eV | NIST |
| IE | 12.39 | eV | NIST |
| IE | 12.91 ± 0.03 | eV | NIST |
| IE | 13.08 ± 0.01 | eV | NIST |
| IE | 13.10 | eV | NIST |
| IE | 13.00 | eV | NIST |
| IE | 13.08 ± 0.02 | eV | NIST |
| log10WS | -1.55 | Crippen Calculated Property | |
| logPoct/wat | 1.745 | Crippen Calculated Property | |
| McVol | 42.500 | ml/mol | McGowan Calculated Property |
| Pc | [3867.94; 3885.00] | kPa |
|
| Pc | 3885.00 ± 6.00 | kPa | NIST |
| Pc | 3868.00 ± 10.00 | kPa | NIST |
| Pc | 3879.00 ± 9.80 | kPa | NIST |
| Pc | 3867.94 | kPa | NIST |
| ρc | [577.66; 598.86] | kg/m3 |
|
| ρc | 598.86 ± 0.52 | kg/m3 | NIST |
| ρc | 577.66 ± 3.13 | kg/m3 | NIST |
| ρc | 582.36 ± 3.13 | kg/m3 | NIST |
| ρc | 579.75 | kg/m3 | NIST |
| Inp | [190.00; 209.00] |
|
|
| Inp | 209.00 | NIST | |
| Inp | 190.00 | NIST | |
| Inp | 190.00 | NIST | |
| Inp | 209.00 | NIST | |
| Tboil | [191.65; 191.80] | K |
|
| Tboil | 191.70 | K | NIST |
| Tboil | 191.65 ± 0.05 | K | NIST |
| Tboil | 191.80 ± 0.30 | K | NIST |
| Tboil | 191.80 ± 0.30 | K | NIST |
| Tc | [301.54; 301.98] | K |
|
| Tc | 301.92 ± 0.08 | K | NIST |
| Tc | 301.90 ± 0.10 | K | NIST |
| Tc | Outlier 301.54 ± 0.20 | K | NIST |
| Tc | 301.92 ± 0.30 | K | NIST |
| Tc | 301.88 ± 0.05 | K | NIST |
| Tc | 301.98 | K | NIST |
| Tc | 301.80 | K | NIST |
| Tfus | [92.03; 92.20] | K |
|
| Tfus | 92.20 ± 0.30 | K | NIST |
| Tfus | 92.03 | K | NIST |
| Ttriple | 92.00 ± 2.00 | K | NIST |
| Vc | 0.183 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [60.54; 78.50] | J/mol×K | [254.29; 403.52] |
|
| Cp,gas | 60.54 | J/mol×K | 254.29 | Joback Calculated Property |
| Cp,gas | 64.09 | J/mol×K | 279.16 | Joback Calculated Property |
| Cp,gas | 67.41 | J/mol×K | 304.03 | Joback Calculated Property |
| Cp,gas | 70.50 | J/mol×K | 328.90 | Joback Calculated Property |
| Cp,gas | 73.37 | J/mol×K | 353.78 | Joback Calculated Property |
| Cp,gas | 76.04 | J/mol×K | 378.65 | Joback Calculated Property |
| Cp,gas | 78.50 | J/mol×K | 403.52 | Joback Calculated Property |
| ΔvapH | [15.70; 17.10] | kJ/mol | [157.50; 285.00] |
|
| ΔvapH | 17.10 | kJ/mol | 157.50 | NIST |
| ΔvapH | 17.00 | kJ/mol | 159.00 | NIST |
| ΔvapH | 16.80 | kJ/mol | 168.50 | NIST |
| ΔvapH | 15.70 | kJ/mol | 215.00 | NIST |
| ΔvapH | 15.70 | kJ/mol | 257.00 | NIST |
| ΔvapH | 16.00 | kJ/mol | 285.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [5.74e-04; 3825.19] | kPa | [92.15; 302.00] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 4.10990e+01 | |||
| Coefficient B | -2.65987e+03 | |||
| Coefficient C | -4.37378e+00 | |||
| Coefficient D | 1.02412e-05 | |||
| Temperature range, min. | 92.15 | |||
| Temperature range, max. | 302.00 | |||
| Pvap | 5.74e-04 | kPa | 92.15 | Calculated Property |
| Pvap | 0.08 | kPa | 115.47 | Calculated Property |
| Pvap | 1.74 | kPa | 138.78 | Calculated Property |
| Pvap | 14.95 | kPa | 162.10 | Calculated Property |
| Pvap | 71.04 | kPa | 185.42 | Calculated Property |
| Pvap | 230.83 | kPa | 208.73 | Calculated Property |
| Pvap | 580.67 | kPa | 232.05 | Calculated Property |
| Pvap | 1222.20 | kPa | 255.37 | Calculated Property |
| Pvap | 2264.79 | kPa | 278.68 | Calculated Property |
| Pvap | 3825.19 | kPa | 302.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Chlorotrifluoromethane.
Sources
- KDB Pure (Korean Thermophysical Properties Databank)
- KDB Vapor Pressure Data
- Crippen Method
- Crippen Method
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
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