N-(1-hydroxy-6-nitroquinolin-4-ylidene)hydroxylamine
Basic information
- CAS
13442-15-4- Standard SMILES
O=[N+]([O-])c1ccc2c(c1)c(=NO)ccn2O- InChIKey
KRGQNZRSACEPDG-UHFFFAOYSA-N- Molecular formula
- C9H7N3O4
- Average molar mass
- 221.17 g/mol
- Monoisotopic mass
- 221.04365571
Names & identifiers
- Preferred name
- N-(1-hydroxy-6-nitroquinolin-4-ylidene)hydroxylamine
- IUPAC
- N-(1-hydroxy-6-nitroquinolin-4-ylidene)hydroxylamine
- English name
- 4-(Hydroxyamino)-6-nitroquinoline 1-oxide
- Molecular formula
- C9H7N3O4
- Molecular weight
- 221.17
Names & synonyms
13442-15-4N-(1-hydroxy-6-nitroquinolin-4-ylidene)hydroxylamineDTXSID409286184-(Hydroxyimino)-6-nitroquinolin-1(4H)-ol6-NITRO-4-HYDROXYLAMINOQUINOLINE1-OXIDE4-(Hydroxyamino)-6-nitroquinoline 1-oxide4-Quinolinamine, N-hydroxy-6-nitro-, 1-oxide
Database identifiers
- CAS
13442-15-4- PubChem CID
- 83464
- DTXSID
DTXSID40928618
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 349
Physicochemical properties
- Boiling point
- 362.22 °C · 362.22°C (rough estimate)
- Density
- 1.4532 · 1.4532 (rough estimate)
- refractive index
- 1.65 · 1.6500 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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