Basic information
- Standard SMILES
O=[N+]([O-])c1c(Cl)ccc2c1ccc[n+]2[O-]- InChIKey
QIGJPXLAPSWKKU-UHFFFAOYSA-N- Molecular formula
- C9H5ClN2O3
- Average molar mass
- 224.6 g/mol
- Monoisotopic mass
- 223.9988697
Names & identifiers
- Preferred name
- 6-Chloro-5-nitroquinoline 1-oxide
- IUPAC
- 6-chloro-5-nitro-1-oxidoquinolin-1-ium
Names & synonyms
SCHEMBL3837881QIGJPXLAPSWKKU-UHFFFAOYSA-N6-Chloro-5-nitroquinoline-N-oxide6-Chloro-5-nitroquinoline 1-oxide6-chloro-5-nitro-quinoline-1-oxideDB-307073569340-00-7
Database identifiers
- PubChem CID
- 68809094
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 71.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 258
Related reactions
3 records
Compound notes
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