- InChI
- InChI=1S/C6H4BrCl2N/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2
- InChI Key
- NPQBZKNXJZARBJ-UHFFFAOYSA-N
- Formula
- C6H4BrCl2N
- SMILES
- Nc1c(Cl)cc(Br)cc1Cl
- Molecular Weight1
- 240.91
- CAS
- 697-86-9
- Other Names
-
- Benzenamine, 2-bromo-4,6-dichloro-
- 2-bromo-4,6-dichloroaniline
- 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).
- 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).
- 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° | 140.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 63.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.06 | kJ/mol | Joback Calculated Property |
| log10WS | -3.64 | Crippen Calculated Property | |
| logPoct/wat | 3.338 | Crippen Calculated Property | |
| McVol | 123.600 | ml/mol | McGowan Calculated Property |
| Pc | 4717.12 | kPa | Joback Calculated Property |
| Tboil | 591.85 | K | Joback Calculated Property |
| Tc | 852.69 | K | Joback Calculated Property |
| Tfus | 424.26 | K | Joback Calculated Property |
| Vc | 0.453 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [215.83; 249.97] | J/mol×K | [591.85; 852.69] | 
|
| Cp,gas | 215.83 | J/mol×K | 591.85 | Joback Calculated Property |
| Cp,gas | 222.78 | J/mol×K | 635.32 | Joback Calculated Property |
| Cp,gas | 229.19 | J/mol×K | 678.80 | Joback Calculated Property |
| Cp,gas | 235.07 | J/mol×K | 722.27 | Joback Calculated Property |
| Cp,gas | 240.47 | J/mol×K | 765.74 | Joback Calculated Property |
| Cp,gas | 245.43 | J/mol×K | 809.22 | Joback Calculated Property |
| Cp,gas | 249.97 | J/mol×K | 852.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Bromo-2,6-dichloroaniline.
Sources
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