chempirical

4-Phenylpyridine 1-oxide

C11H9NOCAS 1131-61-9171.20 g/mol

Open in Covalent MOL file
O−N+

Properties

Molecular formula
C11H9NO
Molar mass
171.20 g/mol
Exact mass
171.0684 Da
Melting point
151–152 °C
logP
1.99Crippen estimate
Polar surface area
26.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
1131-61-9
SMILES
[O-][n+]1ccc(-c2ccccc2)cc1
InChIKey
VZOPVKZLLGMDDG-UHFFFAOYSA-N
InChI
InChI=1S/C11H9NO/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H

Weigh it out

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

Names and synonyms

6 names
  • Pyridine, 4-phenyl-, 1-oxide
  • 4-Phenylpyridine N-oxide
  • 4-Phenylpyridine oxide
  • p-Phenylpyridine N-oxide
  • NSC 187559
  • 1-Oxido-4-phenylpyridin-1-ium

Work with 4-Phenylpyridine 1-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

Biphenyl92-52-450 % similar Para-quaterphenyl135-70-647 % similar 1,1′:4′,1′′:4′′,1′′′:4′′′,1′′′′:4′′′′,1′′′′′-Sexiphenyl4499-83-647 % similar Terphenyl92-94-447 % similar 4-Cyanopyridine N-oxide14906-59-346 % similar Isoquinoline N-oxide1532-72-546 % similar 4-Methylpyridine N-oxide1003-67-446 % similar 4-Chloropyridine N-oxide1121-76-246 % similar

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

Same formula

2-Methylquinoline-6-carboxaldehyde108166-03-6 1-Naphthalenecarboxamide2243-81-4 2-Naphthalenecarboxamide2243-82-5 4-Phenoxypyridine4783-86-2 2-Benzoylpyrrole7697-46-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook