- InChI
- InChI=1S/C6H6BrNO2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H2,8,9,10)
- InChI Key
- STYQHICBPYRHQK-UHFFFAOYSA-N
- Formula
- C6H6BrNO2S
- SMILES
- NS(=O)(=O)c1ccc(Br)cc1
- Molecular Weight1
- 236.09
- CAS
- 701-34-8
- Other Names
-
- p-Bromobenzenesulfonamide
- Benzenesulfonamide, p-bromo-
- Benzenesulfonamide, 4-bromo-
- 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° | -285.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -335.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.60 | kJ/mol | Joback Calculated Property |
| log10WS | -2.33 | Crippen Calculated Property | |
| logPoct/wat | 1.097 | Crippen Calculated Property | |
| McVol | 127.210 | ml/mol | McGowan Calculated Property |
| Pc | 6979.30 | kPa | Joback Calculated Property |
| Tboil | 554.81 | K | Joback Calculated Property |
| Tc | 793.54 | K | Joback Calculated Property |
| Tfus | 377.94 | K | Joback Calculated Property |
| Vc | 0.480 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [251.52; 299.72] | J/mol×K | [554.81; 793.54] | 
|
| Cp,gas | 251.52 | J/mol×K | 554.81 | Joback Calculated Property |
| Cp,gas | 261.40 | J/mol×K | 594.60 | Joback Calculated Property |
| Cp,gas | 270.52 | J/mol×K | 634.39 | Joback Calculated Property |
| Cp,gas | 278.89 | J/mol×K | 674.18 | Joback Calculated Property |
| Cp,gas | 286.54 | J/mol×K | 713.96 | Joback Calculated Property |
| Cp,gas | 293.48 | J/mol×K | 753.75 | Joback Calculated Property |
| Cp,gas | 299.72 | J/mol×K | 793.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Bromobenzenesulfonamide.
Sources
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