- InChI
- InChI=1S/C2H4BrCl/c1-2(3)4/h2H,1H3
- InChI Key
- QMSVNDSDEZTYAS-UHFFFAOYSA-N
- Formula
- C2H4BrCl
- SMILES
- CC(Cl)Br
- Molecular Weight1
- 143.41
- CAS
- 593-96-4
- Other Names
-
- CH3CHClBr
- Ethane, 1-bromo-1-chloro-
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ω | 0.2990 | Relay (1.0) Calculated Property | |
| ΔfG° | -34.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -81.00 ± 3.00 | kJ/mol | NIST |
| ΔfusH° | 6.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [10.37; 10.42] | eV |
|
| IE | 10.37 | eV | NIST |
| IE | 10.42 | eV | NIST |
| log10WS | -1.32 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.966 | Crippen Calculated Property | |
| McVol | 68.780 | ml/mol | McGowan Calculated Property |
| Pc | 5327.93 | kPa | Joback Calculated Property |
| Tboil | 356.20 | K | NIST |
| Tc | 551.96 | K | Relay (1.0) Calculated Property |
| Tfus | 195.50 | K | Relay (1.0) Calculated Property |
| Vc | 0.255 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [86.20; 109.79] | J/mol×K | [348.31; 549.86] |
|
| Cp,gas | 86.20 | J/mol×K | 348.31 | Joback Calculated Property |
| Cp,gas | 90.75 | J/mol×K | 381.90 | Joback Calculated Property |
| Cp,gas | 95.03 | J/mol×K | 415.49 | Joback Calculated Property |
| Cp,gas | 99.07 | J/mol×K | 449.09 | Joback Calculated Property |
| Cp,gas | 102.86 | J/mol×K | 482.68 | Joback Calculated Property |
| Cp,gas | 106.43 | J/mol×K | 516.27 | Joback Calculated Property |
| Cp,gas | 109.79 | J/mol×K | 549.86 | Joback Calculated Property |
| η | [0.0004221; 0.0049301] | Pa×s | [187.02; 348.31] |
|
| η | 0.0049301 | Pa×s | 187.02 | Joback Calculated Property |
| η | 0.0025302 | Pa×s | 213.90 | Joback Calculated Property |
| η | 0.0015071 | Pa×s | 240.78 | Joback Calculated Property |
| η | 0.0009961 | Pa×s | 267.66 | Joback Calculated Property |
| η | 0.0007101 | Pa×s | 294.55 | Joback Calculated Property |
| η | 0.0005357 | Pa×s | 321.43 | Joback Calculated Property |
| η | 0.0004221 | Pa×s | 348.31 | Joback Calculated Property |
| ΔvapH | [33.10; 46.70] | kJ/mol | [296.50; 323.00] |
|
| ΔvapH | 46.70 | kJ/mol | 296.50 | NIST |
| ΔvapH | 33.10 | kJ/mol | 323.00 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 354.10 ± 0.50 | K | 98.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [263.29; 382.52] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.18014e+01 | |||
| Coefficient B | -1.77343e+03 | |||
| Coefficient C | -1.09259e+02 | |||
| Temperature range, min. | 263.29 | |||
| Temperature range, max. | 382.52 | |||
| Pvap | 1.33 | kPa | 263.29 | Calculated Property |
| Pvap | 3.32 | kPa | 276.54 | Calculated Property |
| Pvap | 7.23 | kPa | 289.79 | Calculated Property |
| Pvap | 14.14 | kPa | 303.03 | Calculated Property |
| Pvap | 25.41 | kPa | 316.28 | Calculated Property |
| Pvap | 42.53 | kPa | 329.53 | Calculated Property |
| Pvap | 67.15 | kPa | 342.78 | Calculated Property |
| Pvap | 100.96 | kPa | 356.02 | Calculated Property |
| Pvap | 145.60 | kPa | 369.27 | Calculated Property |
| Pvap | 202.66 | kPa | 382.52 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Bromo-1-chloroethane.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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