Basic information
- CAS
3039-74-5- Standard SMILES
O=c1ccn(O)c2ccccc12- InChIKey
AJTLULFWRGRNEZ-UHFFFAOYSA-N- Molecular formula
- C9H7NO2
- Average molar mass
- 161.16 g/mol
- Monoisotopic mass
- 161.04767847
Names & identifiers
- Preferred name
- 4-Quinolinol, 1-oxide
- IUPAC
- 1-hydroxyquinolin-4-one
- English name
- 4-Hydroxyquinoline-N-oxide
- Molecular formula
- C9H7NO2
- Molecular weight
- 161.16
Names & synonyms
4-Quinolinol, 1-oxide3039-74-54-Hydroxyquinoline 1-oxide1-hydroxyquinolin-4-one4-hydroxyquinoline-N-oxide1-hydroxyquinolin-4(1h)-one4HAQOquinoline-1,4-diol1-oxidanylquinolin-4-one4-hydroxyquinoline-1-oxideSCHEMBL1193736SCHEMBL6667748
Show more names
DTXSID60952733WDSYZNBUDXWINJ-UHFFFAOYSA-N1-Oxo-1lambda~5~-quinolin-4-olSBB087512AKOS006272484AC-907/25004898
Database identifiers
- CAS
3039-74-5- PubChem CID
- 76437
- DTXSID
DTXSID60952733- Nikkaji
- J1.582.441G、J2.198.450G
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 225
Experimental & physicochemical properties
LogP-0.47
Chemistry & industry
Suppliers4 total
武汉布林科技有限公司3456065315 13260619011 · [email protected]
济南凯西生物科技有限公司13370511208 15853141736 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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