Basic information
- CAS
473477-04-2- Standard SMILES
CN(C)S(=O)(=O)c1cc(C#N)ccc1Br- InChIKey
FIOPKAZLAKVVFF-UHFFFAOYSA-N- Molecular formula
- C9H9BrN2O2S
- Average molar mass
- 289.15 g/mol
- Monoisotopic mass
- 287.95681
Names & identifiers
- Preferred name
- 2-bromo-5-cyano-N,N-dimethylbenzenesulfonamide
- IUPAC
- 2-bromo-5-cyano-N,N-dimethylbenzenesulfonamide
Names & synonyms
2-bromo-5-cyano-N,N-dimethylbenzenesulfonamideSCHEMBL7214174DTXSID401247314473477-04-22-Bromo-5-cyano-N,N-dimethylbenzene-1-sulfonamide
Database identifiers
- CAS
473477-04-2- PubChem CID
- 9922012
- DTXSID
DTXSID401247314
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 365
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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