Basic information
- CAS
56764-43-3- Standard SMILES
Cc1ccc(S(=O)(=O)N[N+](=O)[O-])cc1- InChIKey
XRBIVTYUKPDCMI-UHFFFAOYSA-N- Molecular formula
- C7H8N2O4S
- Average molar mass
- 216.22 g/mol
- Monoisotopic mass
- 216.02047791
Names & identifiers
- Preferred name
- Benzenesulfonamide, 4-methyl-N-nitro-
- IUPAC
- 4-methyl-N-nitrobenzenesulfonamide
Names & synonyms
N-Nitro-p-toluenesulfonamideBRN 221551356764-43-3p-Toluenesulfonamide, N-nitro-Benzenesulfonamide, 4-methyl-N-nitro-DTXSID802053192-11-00-00067 (Beilstein Handbook Reference)RefChem:325378DTXCID30127810Benzenesulfonamide, 4-methyl-N-nitro-(9CI)Benzenesulfonamide, 4-methyl-N-nitro- (9CI)SCHEMBL27609224
Show more names
4-Methyl-N-nitrobenzene-1-sulfonamide
Database identifiers
- CAS
56764-43-3- PubChem CID
- 3044151
- DTXSID
DTXSID80205319- Nikkaji
- J85.037C
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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