5,8-Dibromo-5,8-dinitrododecane-2,11-dione
Basic information
- CAS
7404-83-3- Standard SMILES
CC(=O)CCC(Br)(CCC(Br)(CCC(C)=O)[N+](=O)[O-])[N+](=O)[O-]- InChIKey
SLQWDVMCAZEWKN-UHFFFAOYSA-N- Molecular formula
- C12H18Br2N2O6
- Average molar mass
- 446.09 g/mol
- Monoisotopic mass
- 443.95316
Names & identifiers
- Preferred name
- 5,8-Dibromo-5,8-dinitrododecane-2,11-dione
- IUPAC
- 5,8-dibromo-5,8-dinitrododecane-2,11-dione
Names & synonyms
7404-83-35,8-dibromo-5,8-dinitrododecane-2,11-dioneNSC403132DTXSID30323138NSC-403132
Database identifiers
- CAS
7404-83-3- PubChem CID
- 345491
- DTXSID
DTXSID30323138
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 420
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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