Basic information
- CAS
35467-01-7- Standard SMILES
[N-]=[N+]=CC(=O)CN(CC(=O)C=[N+]=[N-])[N+](=O)[O-]- InChIKey
BDYOHXBIKQLURK-UHFFFAOYSA-N- Molecular formula
- C6H6N6O4
- Average molar mass
- 226.15 g/mol
- Monoisotopic mass
- 226.04505269
Names & identifiers
- Preferred name
- 2-Propanone, 1,1'-nitroiminobis(3-diazo-
- IUPAC
- N,N-bis(3-diazo-2-oxopropyl)nitramide
Names & synonyms
2-Propanone, 1,1'-nitroiminobis(3-diazo-35467-01-7RefChem:10643041,1'-Nitroiminobis(3-diazo-2-propanone)
Database identifiers
- CAS
35467-01-7- PubChem CID
- 215329
- Nikkaji
- J87.527I
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 87.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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