- InChI
- InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)
- InChI Key
- KHBQMWCZKVMBLN-UHFFFAOYSA-N
- Formula
- C6H7NO2S
- SMILES
- NS(=O)(=O)c1ccccc1
- Molecular Weight1
- 157.19
- CAS
- 98-10-2
- Other Names
-
- BSA
- Benzenesulphonamide
- Benzosulfonamide
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,solid : Solid phase heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (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).
- 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 |
|---|---|---|---|
| ω | 0.5246 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -3400.00 | kJ/mol | NIST |
| ΔfG° | -290.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -225.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -561.90 | kJ/mol | NIST |
| ΔfusH° | 23.74 | kJ/mol | Enthalpies of combustion and formation of benzenesulfonamide and some of its derivatives |
| ΔsubH° | 115.30 ± 1.70 | kJ/mol | NIST |
| ΔvapH° | 78.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.49 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.56 | Aq. Solubility Prediction | |
| logPoct/wat | 0.334 | Crippen Calculated Property | |
| McVol | 109.710 | ml/mol | McGowan Calculated Property |
| Pc | 6389.77 | kPa | Joback Calculated Property |
| Inp | [1525.00; 1525.00] |
|
|
| Inp | 1525.00 | NIST | |
| Inp | 1525.00 | NIST | |
| Tboil | 549.53 | K | Relay (1.0) Calculated Property |
| Tc | 801.82 | K | Relay (1.0) Calculated Property |
| Tfus | [424.82; 429.65] | K |
|
| Tfus | 424.82 | K | Aq. Solubility Prediction |
| Tfus | 425.35 | K | Solubility Determination, Modeling, and Thermodynamic Dissolution Properties of Benzenesulfonamide in 16 Neat Solvents from 273.15 to 324.45 K |
| Tfus | 429.65 ± 1.00 | K | NIST |
| Vc | 0.388 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [219.71; 276.47] | J/mol×K | [483.67; 705.60] |
|
| Cp,gas | 219.71 | J/mol×K | 483.67 | Joback Calculated Property |
| Cp,gas | 230.91 | J/mol×K | 520.66 | Joback Calculated Property |
| Cp,gas | 241.40 | J/mol×K | 557.65 | Joback Calculated Property |
| Cp,gas | 251.19 | J/mol×K | 594.64 | Joback Calculated Property |
| Cp,gas | 260.29 | J/mol×K | 631.62 | Joback Calculated Property |
| Cp,gas | 268.72 | J/mol×K | 668.61 | Joback Calculated Property |
| Cp,gas | 276.47 | J/mol×K | 705.60 | Joback Calculated Property |
| Cp,solid | 193.30 | J/mol×K | 323.00 | NIST |
| ΔfusH | 25.17 | kJ/mol | 425.80 | NIST |
Similar Compounds
Find more compounds similar to Benzenesulfonamide.
Mixtures
- Benzenesulfonamide + Methyl Alcohol
- Benzenesulfonamide + Ethanol
- 1-Propanol + Benzenesulfonamide
- Isopropyl Alcohol + Benzenesulfonamide
- Benzenesulfonamide + 1-Butanol
- Benzenesulfonamide + 1-Propanol, 2-methyl-
- Benzenesulfonamide + 1-Pentanol
- Benzenesulfonamide + 1-Butanol, 3-methyl-
- Benzenesulfonamide + Acetone
- Benzenesulfonamide + Ethyl Acetate
- Acetonitrile + Benzenesulfonamide
- Benzenesulfonamide + Cyclohexanone
- Benzenesulfonamide + Cyclopentanone
- Benzenesulfonamide + Acetic acid, methyl ester
- Ethyl formate + Benzenesulfonamide
- Benzenesulfonamide + Methylene chloride
- Benzenesulfonamide + Carbon dioxide
- Benzenesulfonamide + Carbon dioxide + Ethanol
- Benzenesulfonamide + Carbon dioxide + 1,2-Ethanediol
- Benzenesulfonamide + Carbon dioxide + Ethyl Acetate
Find more mixtures with Benzenesulfonamide.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Enthalpies of combustion and formation of benzenesulfonamide and some of its derivatives
- Solubilities of benzene sulfonamide in supercritical CO2 in the absence and presence of cosolvent
- Solubility Determination, Modeling, and Thermodynamic Dissolution Properties of Benzenesulfonamide in 16 Neat Solvents from 273.15 to 324.45 K
- Joback Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.