- InChI
- InChI=1S/C6H4BrClO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
- InChI Key
- VIBJPUXLAKVICD-UHFFFAOYSA-N
- Formula
- C6H4BrClO
- SMILES
- Oc1ccc(Br)cc1Cl
- Molecular Weight1
- 207.45
- CAS
- 3964-56-5
- Other Names
-
- 4-Bromo-2-chlorophenol
- 2-Chloro-4-bromophenol
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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 |
|---|---|---|---|
| ΔfG° | -49.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -108.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.72 | kJ/mol | Joback Calculated Property |
| log10WS | -2.87 | Crippen Calculated Property | |
| logPoct/wat | 2.808 | Crippen Calculated Property | |
| McVol | 107.250 | ml/mol | McGowan Calculated Property |
| Pc | 5944.56 | kPa | Joback Calculated Property |
| Inp | [1265.40; 1265.40] |
|
|
| Inp | 1265.40 | NIST | |
| Inp | 1265.40 | NIST | |
| Tboil | 506.70 | K | NIST |
| Tc | 810.23 | K | Joback Calculated Property |
| Tfus | 397.76 | K | Joback Calculated Property |
| Vc | 0.341 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [193.10; 226.87] | J/mol×K | [552.55; 810.23] |
|
| Cp,gas | 193.10 | J/mol×K | 552.55 | Joback Calculated Property |
| Cp,gas | 200.12 | J/mol×K | 595.50 | Joback Calculated Property |
| Cp,gas | 206.43 | J/mol×K | 638.44 | Joback Calculated Property |
| Cp,gas | 212.15 | J/mol×K | 681.39 | Joback Calculated Property |
| Cp,gas | 217.39 | J/mol×K | 724.33 | Joback Calculated Property |
| Cp,gas | 222.25 | J/mol×K | 767.28 | Joback Calculated Property |
| Cp,gas | 226.87 | J/mol×K | 810.23 | Joback Calculated Property |
| η | [0.0000765; 0.0011327] | Pa×s | [397.76; 552.55] |
|
| η | 0.0011327 | Pa×s | 397.76 | Joback Calculated Property |
| η | 0.0006305 | Pa×s | 423.56 | Joback Calculated Property |
| η | 0.0003753 | Pa×s | 449.36 | Joback Calculated Property |
| η | 0.0002364 | Pa×s | 475.15 | Joback Calculated Property |
| η | 0.0001561 | Pa×s | 500.95 | Joback Calculated Property |
| η | 0.0001074 | Pa×s | 526.75 | Joback Calculated Property |
| η | 0.0000765 | Pa×s | 552.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 4-bromo-2-chloro-.
Sources
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