Basic information
- Standard SMILES
CN(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])S(=O)(=O)c1ccccc1- InChIKey
RVJBETOBGNYPIQ-UHFFFAOYSA-N- Molecular formula
- C13H11N3O6S
- Average molar mass
- 337.31 g/mol
Names & identifiers
- Preferred name
- 2',4'-Dinitro-N-methylbenzenesulfonanilide
- IUPAC
- N-(2,4-dinitrophenyl)-N-methylbenzenesulfonamide
Names & synonyms
SCHEMBL7182288RVJBETOBGNYPIQ-UHFFFAOYSA-N2',4'-Dinitro-N-methylbenzenesulfonanilide
Database identifiers
- PubChem CID
- 18509331
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 544
Related reactions
2 records
Compound notes
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