chempirical

8-Hydroxyquinoline N-oxide

C9H7NO2CAS 1127-45-3161.16 g/mol

Open in Covalent MOL file
O−N+OH
Phenol

Properties

Molecular formula
C9H7NO2
Molar mass
161.16 g/mol
Exact mass
161.0477 Da
Melting point
138 °C
logP
1.18Crippen estimate
Polar surface area
47.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
1127-45-3
SMILES
[O-][n+]1cccc2cccc(O)c21
InChIKey
FJKUOCCQEBLPNX-UHFFFAOYSA-N
InChI
InChI=1S/C9H7NO2/c11-8-5-1-3-7-4-2-6-10(12)9(7)8/h1-6,11H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • 8-Quinolinol, 1-oxide
  • 8-Hydroxyquinoline 1-oxide
  • o-Hydroxyquinoline N-oxide
  • 8-Quinolinol N-oxide
  • NSC 21656

Work with 8-Hydroxyquinoline N-oxide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Quinoline N-oxide1613-37-245 % similar 1,8-Dihydroxynaphthalene569-42-641 % similar 2-Hydroxypyridine N-oxide13161-30-341 % similar 1-Naphthol90-15-340 % similar 2-Chloropyridine N-oxide2402-95-136 % similar 1,8,9-Anthracenetriol480-22-835 % similar 1,5-Dihydroxynaphthalene83-56-734 % similar Pyrogallol87-66-134 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Phenyl-5(4H)-isoxazolone1076-59-1 7-Methylisatin1127-59-9 Methyl 4-cyanobenzoate1129-35-7 Methyl m-cyanobenzoate13531-48-1 Indole-2-carboxylic acid1477-50-5 8-Hydroxy-1H-quinolin-2-one15450-76-7 3-Aminocoumarin1635-31-0 1H-Indole-5-carboxylic acid1670-81-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook