chempirical

2-Benzoylpyridine

C12H9NOCAS 91-02-1183.21 g/mol

Open in Covalent MOL file
ON
Ketone

Properties

Molecular formula
C12H9NO
Molar mass
183.21 g/mol
Exact mass
183.0684 Da
Density
1.15 g/mL
Melting point
42 °C
Boiling point
317 °C
logP
2.31Crippen estimate
Polar surface area
30.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
91-02-1
SMILES
O=C(c1ccccc1)c1ccccn1
InChIKey
GCSHUYKULREZSJ-UHFFFAOYSA-N
InChI
InChI=1S/C12H9NO/c14-12(10-6-2-1-3-7-10)11-8-4-5-9-13-11/h1-9H

Weigh it out

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

Names and synonyms

8 names
  • Methanone, phenyl-2-pyridinyl-
  • Ketone, phenyl 2-pyridyl
  • Phenyl-2-pyridinylmethanone
  • Phenyl 2-pyridyl ketone
  • 2-Pyridyl phenyl ketone
  • NSC 20887
  • 2′-Benzoylpyridine
  • 1-(Pyridin-2′-yl)-phenylmethanone

Work with 2-Benzoylpyridine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Pyridyl ketone19437-26-476 % similar (4-Chlorophenyl)-2-pyridinylmethanone6318-51-071 % similar 2,2′-Pyridil492-73-957 % similar 1,4-Dibenzoylbenzene3016-97-554 % similar 1,3-Di(2-pyridyl)-1,3-propanedione10198-89-752 % similar 2-Acetylpyridine1122-62-952 % similar Picolinic acid98-98-652 % similar 1,2-Dibenzoylbenzene1159-86-050 % similar

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

Same formula

4-(Pyridin-3-yl)benzaldehyde127406-55-7 4-(2-Pyridinyl)benzaldehyde127406-56-8 3-(3-Pyridyl)benzaldehyde131231-24-8 Phenoxazine135-67-1 4-Benzoylpyridine14548-46-0 2-(4-Pyridinyl)benzaldehyde176526-00-4 2-Methylnaphth[2,3-D]oxazole20686-66-2 3-Dibenzofuranamine4106-66-5

Elsewhere

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