Dipyrido(1,2-a:3',2'-d)imidazole, 3-nitro-
Basic information
- CAS
98046-75-4- Standard SMILES
O=[N+]([O-])c1cnc2c(c1)nc1ccccn12- InChIKey
RMBFLFDSKVVMBP-UHFFFAOYSA-N- Molecular formula
- C10H6N4O2
- Average molar mass
- 214.18 g/mol
- Monoisotopic mass
- 214.04907545
Names & identifiers
- Preferred name
- Dipyrido(1,2-a:3',2'-d)imidazole, 3-nitro-
- IUPAC
- 5-nitro-1,3,8-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,10,12-hexaene
Names & synonyms
Dipyrido(1,2-a:3',2'-d)imidazole, 3-nitro-3-Nitrodipyrido(1,2-a:3',2'-d)imidazole98046-75-4CCRIS 61343-NITRODIPYRIDO[1,2-A:3',2'-D]IMIDAZOLEDTXSID602433903-nitroimidazo[1,2-a:5,4-b']dipyridine
Database identifiers
- CAS
98046-75-4- PubChem CID
- 152168
- DTXSID
DTXSID60243390
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 293
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Compound notes
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