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| CAS No.: | 1678-25-7 |
|---|---|
| Name: | Benzenesulfonanilide |
| Article Data: | 161 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C12H11NO2S |
| Molecular Weight: | 233.291 |
| Synonyms: | Benzenesulfonanilide(6CI,8CI);N-Benzenesulfonylaniline;N-Phenylbenzenesulfonamide;NSC 30178;NSC48357; |
| EINECS: | 216-832-4 |
| Density: | 1.307 g/cm3 |
| Melting Point: | 110 °C |
| Boiling Point: | 381.312 °C at 760 mmHg |
| Flash Point: | 184.411 °C |
| Safety: | 22-24/25 |
| PSA: | 54.55000 |
| LogP: | 3.64120 |
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Chemistry
Molecular Formula: C12H11NO2S
Molar mass: 233.29 g/mol
EINECS: 216-832-4
Density: 1.306 g/cm3
Flash Point: 184.4 °C
Index of Refraction: 1.635
Boiling Point: 381.3 °C at 760 mmHg
Vapour Pressure: 5.12E-06 mmHg at 25°C
Melting point: 110°C
Product categories of Benzenesulfonanilide (1678-25-7): API intermediates
Structure of Benzenesulfonanilide (1678-25-7):
XLogP3-AA: 2.6
H-Bond Donor: 1
H-Bond Acceptor: 3
Systematic Name: N-Phenylbenzenesulfonamide
SMILES: O=S(=O)(Nc1ccccc1)c2ccccc2
InChI: InChI=1/C12H11NO2S/c14-16(15,12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10,13H
InChIKey: XAUGWFWQVYXATQ-UHFFFAOYAM
Std. InChI: InChI=1S/C12H11NO2S/c14-16(15,12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10,13H
Std. InChIKey: XAUGWFWQVYXATQ-UHFFFAOYSA-N
Safety Profile
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits very toxic fumes of SOx and NOx.
Safety Statements:
22: Do not breathe dust
24: Avoid contact with skin
25: Avoid contact with eyes
Specification
Benzenesulfonanilide (1678-25-7) also can be called N-Phenylbenzenesulphonamide ; (Benzenesulfonamide, N-phenyl- ; Benzoylsulfanilide .