- InChI
- InChI=1S/C2H2Br2Cl2/c3-1-2(4,5)6/h1H2
- InChI Key
- FIYBYNHDEOSJPL-UHFFFAOYSA-N
- Formula
- C2H2Br2Cl2
- SMILES
- ClC(Cl)(Br)CBr
- Molecular Weight1
- 256.75
- CAS
- 75-81-0
- Other Names
-
- Ethane, 1,2-dibromo-1,1-dichloro-
- 1,2-Dibromo-2,2-dichloroethane
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -68.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.71 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.908 | Crippen Calculated Property | |
| McVol | 98.520 | ml/mol | McGowan Calculated Property |
| Inp | 1072.00 | NIST | |
| Tboil | 449.23 | K | Relay (1.0) Calculated Property |
| Tfus | 206.30 ± 0.02 | K | NIST |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [129.37; 147.88] | J/mol×K | [449.31; 692.01] | 
|
| Cp,gas | 129.37 | J/mol×K | 449.31 | Joback Calculated Property |
| Cp,gas | 133.78 | J/mol×K | 489.76 | Joback Calculated Property |
| Cp,gas | 137.57 | J/mol×K | 530.21 | Joback Calculated Property |
| Cp,gas | 140.81 | J/mol×K | 570.66 | Joback Calculated Property |
| Cp,gas | 143.56 | J/mol×K | 611.11 | Joback Calculated Property |
| Cp,gas | 145.89 | J/mol×K | 651.56 | Joback Calculated Property |
| Cp,gas | 147.88 | J/mol×K | 692.01 | Joback Calculated Property |
| η | [0.0005135; 0.0035685] | Pa×s | [294.16; 449.31] |
|
| η | 0.0035685 | Pa×s | 294.16 | Joback Calculated Property |
| η | 0.0022671 | Pa×s | 320.02 | Joback Calculated Property |
| η | 0.0015414 | Pa×s | 345.88 | Joback Calculated Property |
| η | 0.0011058 | Pa×s | 371.74 | Joback Calculated Property |
| η | 0.0008283 | Pa×s | 397.59 | Joback Calculated Property |
| η | 0.0006427 | Pa×s | 423.45 | Joback Calculated Property |
| η | 0.0005135 | Pa×s | 449.31 | Joback Calculated Property |
| ΔvapH | 45.90 | kJ/mol | 436.50 | NIST |
Similar Compounds
Find more compounds similar to 1,2-Dibromo-1,1-dichloroethane.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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