- InChI
- InChI=1S/C2HBrClF3/c3-2(6,7)1(4)5/h1H
- InChI Key
- KFTODZKBBUMDQB-UHFFFAOYSA-N
- Formula
- C2HBrClF3
- SMILES
- FC(Cl)C(F)(F)Br
- Molecular Weight1
- 197.38
- CAS
- 354-06-3
- Other Names
-
- 1,1,2-Trifluoro-1-bromo-2-chloroethane
- Ethane, 1-bromo-2-chloro-1,1,2-trifluoro-
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- 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).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (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 |
|---|---|---|---|
| ΔcH°liquid | -806.30 ± 5.20 | kJ/mol | NIST |
| ΔfG° | -615.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -654.70 ± 5.60 | kJ/mol | NIST |
| ΔfH°liquid | -675.30 ± 6.40 | kJ/mol | NIST |
| ΔfusH° | 8.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [30.00; 30.50] | kJ/mol |
|
| ΔvapH° | 30.12 | kJ/mol | NIST |
| ΔvapH° | 30.00 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 30.50 | kJ/mol | NIST |
| log10WS | -2.51 | Crippen Calculated Property | |
| logPoct/wat | 2.509 | Crippen Calculated Property | |
| McVol | 74.090 | ml/mol | McGowan Calculated Property |
| Pc | 4528.58 | kPa | Joback Calculated Property |
| Tboil | [325.50; 325.60] | K |
|
| Tboil | 325.50 ± 2.50 | K | NIST |
| Tboil | 325.60 | K | NIST |
| Tc | 499.80 | K | NIST |
| Tfus | 146.20 ± 0.20 | K | NIST |
| Vc | 0.295 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [112.10; 137.51] | J/mol×K | [342.89; 523.53] |
|
| Cp,gas | 112.10 | J/mol×K | 342.89 | Joback Calculated Property |
| Cp,gas | 117.35 | J/mol×K | 373.00 | Joback Calculated Property |
| Cp,gas | 122.16 | J/mol×K | 403.10 | Joback Calculated Property |
| Cp,gas | 126.55 | J/mol×K | 433.21 | Joback Calculated Property |
| Cp,gas | 130.56 | J/mol×K | 463.31 | Joback Calculated Property |
| Cp,gas | 134.21 | J/mol×K | 493.42 | Joback Calculated Property |
| Cp,gas | 137.51 | J/mol×K | 523.53 | Joback Calculated Property |
| Cp,liquid | 160.30 | J/mol×K | 298.15 | NIST |
| ΔfusH | [4.38; 4.38] | kJ/mol | [146.20; 146.20] |
|
| ΔfusH | 4.38 | kJ/mol | 146.20 | NIST |
| ΔfusH | 4.38 | kJ/mol | 146.20 | NIST |
| ΔfusH | 4.38 | kJ/mol | 146.20 | NIST |
| ΔvapH | [27.20; 29.00] | kJ/mol | [313.00; 343.00] |
|
| ΔvapH | 29.00 ± 0.10 | kJ/mol | 313.00 | NIST |
| ΔvapH | 28.31 | kJ/mol | 325.60 | NIST |
| ΔvapH | 28.10 ± 0.10 | kJ/mol | 328.00 | NIST |
| ΔvapH | 27.20 ± 0.10 | kJ/mol | 343.00 | NIST |
| ΔfusS | 29.90 | J/mol×K | 146.20 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [238.63; 348.16] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.34672e+01 | |||
| Coefficient B | -2.34327e+03 | |||
| Coefficient C | -6.08390e+01 | |||
| Temperature range, min. | 238.63 | |||
| Temperature range, max. | 348.16 | |||
| Pvap | 1.33 | kPa | 238.63 | Calculated Property |
| Pvap | 3.10 | kPa | 250.80 | Calculated Property |
| Pvap | 6.52 | kPa | 262.97 | Calculated Property |
| Pvap | 12.59 | kPa | 275.14 | Calculated Property |
| Pvap | 22.65 | kPa | 287.31 | Calculated Property |
| Pvap | 38.40 | kPa | 299.48 | Calculated Property |
| Pvap | 61.83 | kPa | 311.65 | Calculated Property |
| Pvap | 95.27 | kPa | 323.82 | Calculated Property |
| Pvap | 141.30 | kPa | 335.99 | Calculated Property |
| Pvap | 202.67 | kPa | 348.16 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Bromo-2-chloro-1,1,2-trifluoroethane.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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