N-(1-nitro-4,5-dihydroimidazol-2-yl)methanesulfonamide
Basic information
- CAS
7401-44-7- Standard SMILES
CS(=O)(=O)NC1=NCCN1[N+](=O)[O-]- InChIKey
MMSWFAYPDCNSFF-UHFFFAOYSA-N- Molecular formula
- C4H8N4O4S
- Average molar mass
- 208.2 g/mol
- Monoisotopic mass
- 208.02662592
Names & identifiers
- Preferred name
- N-(1-nitro-4,5-dihydroimidazol-2-yl)methanesulfonamide
- IUPAC
- N-(1-nitro-4,5-dihydroimidazol-2-yl)methanesulfonamide
Names & synonyms
NSC389487401-44-7n-(1-nitro-4,5-dihydro-1h-imidazol-2-yl)methanesulfonamideN-(1-nitro-4,5-dihydroimidazol-2-yl)methanesulfonamideDTXSID80995309NSC-38948Methanesulfonamide, N-(4,5-dihydro-1-nitro-1H-imidazol-2-yl)-
Database identifiers
- CAS
7401-44-7- PubChem CID
- 236433
- DTXSID
DTXSID80995309
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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