Basic information
- CAS
6973-38-2- Standard SMILES
O=[N+]([O-])c1cc(Br)ccc1Oc1ccc(Br)cc1[N+](=O)[O-]- InChIKey
CNWGHUMFQXLORJ-UHFFFAOYSA-N- Molecular formula
- C12H6Br2N2O5
- Average molar mass
- 417.99 g/mol
- Monoisotopic mass
- 415.86435
Names & identifiers
- Preferred name
- 1,1'-Oxybis(4-bromo-2-nitrobenzene)
- IUPAC
- 4-bromo-1-(4-bromo-2-nitrophenoxy)-2-nitrobenzene
Names & synonyms
6973-38-21,1'-oxybis(4-bromo-2-nitrobenzene)4-bromo-1-(4-bromo-2-nitrophenoxy)-2-nitrobenzeneNSC40570DTXSID60285119NSC-40570AKOS014767110
Database identifiers
- CAS
6973-38-2- PubChem CID
- 237245
- DTXSID
DTXSID60285119
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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