3,8-Diazido-5-ethyl-6-phenylphenanthridinium bromide
Basic information
- CAS
57512-42-2- Standard SMILES
CCn1c2cc(=N[N+]#N)ccc-2c2ccc(N=[N+]=[N-])cc2c1-c1ccccc1.[Br-]- InChIKey
MTYCFDOUVQLBPB-UHFFFAOYSA-M- Molecular formula
- C21H16BrN7
- Average molar mass
- 446.3 g/mol
- Monoisotopic mass
- 445.06506
Names & identifiers
- Preferred name
- 3,8-Diazido-5-ethyl-6-phenylphenanthridinium bromide
- IUPAC
- 8-azido-3-diazonioimino-5-ethyl-6-phenylphenanthridine bromide
Names & synonyms
57512-42-2Diazido ethidium bromide3,8-Diazido-5-ethyl-6-phenylphenanthridinium bromidePhenanthridinium, 3,8-diazido-5-ethyl-6-phenyl-, bromideDTXSID609730493-(8-Azido-5-ethyl-6-phenylphenanthridin-3(5H)-ylidene)triaz-1-yn-2-ium bromide
Database identifiers
- CAS
57512-42-2- PubChem CID
- 148808
- DTXSID
DTXSID60973049
Properties
Computed structural properties
- Topological polar surface area
- 58.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 1,010
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Compound notes
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