Basic information
- CAS
55556-89-3- Standard SMILES
O=NN1CCCN(N=O)CCC1- InChIKey
URLYYQHDXKNTGO-UHFFFAOYSA-N- Molecular formula
- C6H12N4O2
- Average molar mass
- 172.19 g/mol
- Monoisotopic mass
- 172.09602564
Names & identifiers
- Preferred name
- 1,5-Dinitroso-1,5-diazocane
- IUPAC
- 1,5-dinitroso-1,5-diazocane
- English name
- 1,5-Dinitrosooctahydro-1,5-diazocine
- Molecular formula
- C6H12N4O2
- Molecular weight
- 172.19
Names & synonyms
1,5-Dinitrosooctahydro-1,5-diazocine1,5-Diazocine, octahydro-1,5-dinitroso-55556-89-31,5-Dinitroso-1,5-diazocaneURLYYQHDXKNTGO-UHFFFAOYSA-N1,5-Dinitroso-1,5-diazocane #DTXSID601354585DB-322706
Database identifiers
- CAS
55556-89-3- PubChem CID
- 558352
- DTXSID
DTXSID601354585- Nikkaji
- J128.165H
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 65.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 138
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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