Basic information
- CAS
346458-49-9- Standard SMILES
O=[n+]1cc(-c2ccccc2)n([O-])c2cc(Cl)ccc21- InChIKey
COUYXHWIPSRLNM-UHFFFAOYSA-N- Molecular formula
- C14H9ClN2O2
- Average molar mass
- 272.68 g/mol
- Monoisotopic mass
- 272.0352552
Names & identifiers
- Preferred name
- Quinoxaline, 7-chloro-2-phenyl-, 1,4-dioxide
- IUPAC
- 6-chloro-4-oxido-3-phenylquinoxalin-1-ium 1-oxide
Names & synonyms
Quinoxaline, 7-chloro-2-phenyl-, 1,4-dioxide346458-49-9DTXSID60347584RefChem:378905DTXCID902986566-Chloro-1-oxo-3-phenylquinoxalin-1-ium-4(1H)-olate
Database identifiers
- CAS
346458-49-9- PubChem CID
- 623301
- DTXSID
DTXSID60347584
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 46.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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