N-(2-Nitrophenyl)benzenesulfonamide
Basic information
- CAS
6933-51-3- Standard SMILES
O=[N+]([O-])c1ccccc1NS(=O)(=O)c1ccccc1- InChIKey
QYEQJQLZLZRQEB-UHFFFAOYSA-N- Molecular formula
- C12H10N2O4S
- Average molar mass
- 278.29 g/mol
- Monoisotopic mass
- 278.03612798
Names & identifiers
- Preferred name
- N-(2-Nitrophenyl)benzenesulfonamide
- IUPAC
- N-(2-nitrophenyl)benzenesulfonamide
- English name
- N-(2-nitrophenyl)benzenesulfonamide
- Molecular formula
- C12H10N2O4S
- Molecular weight
- 278.28
Names & synonyms
N-(2-Nitrophenyl)benzenesulfonamide6933-51-3MFCD00193728benzenesulfonamide, n-(2-nitrophenyl)-2'-NitrobenzenesulfonanilideMLS002920542NSC142099CHEMBL448843SCHEMBL2003165SCHEMBL30561863DTXSID50301256QYEQJQLZLZRQEB-UHFFFAOYSA-N
Show more names
ALBB-023595(2-nitrophenyl)(phenylsulfonyl)amineSTK090834AKOS000493657N-(2-Nitrophenyl)benzenesulfonamide #NSC-142099SB81790LS-07447
Database identifiers
- CAS
6933-51-3- PubChem CID
- 285267
- DTXSID
DTXSID50301256- ChEMBL
CHEMBL448843- Nikkaji
- J1.127.754C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 406
Experimental & physicochemical properties
LogP2.08
Physicochemical properties
- Melting point
- 102.2 · 102.2-102.5 °C
- Boiling point
- 451.3 · 451.3±47.0 °C(Predicted)
- Density
- 1.461 · 1.461±0.06 g/cm3(Predicted)
- pka
- 7.26 · 7.26±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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