chempirical

3-Methylbenzophenone

C14H12OCAS 643-65-2196.25 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C14H12O
Molar mass
196.25 g/mol
Exact mass
196.0888 Da
Density
1.095 g/mL (at 20 °C)
Melting point
159–160 °C
Boiling point
317 °C
logP
3.23Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
643-65-2
SMILES
Cc1cccc(C(=O)c2ccccc2)c1
InChIKey
URBLVRAVOIVZFJ-UHFFFAOYSA-N
InChI
InChI=1S/C14H12O/c1-11-6-5-9-13(10-11)14(15)12-7-3-2-4-8-12/h2-10H,1H3

Weigh it out

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

Names and synonyms

8 names
  • Methanone, (3-methylphenyl)phenyl-
  • Benzophenone, 3-methyl-
  • (3-Methylphenyl)phenylmethanone
  • m-Methylbenzophenone
  • Phenyl m-tolyl ketone
  • 3-Benzoyltoluene
  • Phenyl 3-tolyl ketone
  • Phenyl(m-tolyl)methanone

Work with 3-Methylbenzophenone

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

3,4'-Dimethylbenzophenone13152-94-885 % similar 1,3-Dibenzoylbenzene3770-82-972 % similar 3,4-Dimethylbenzophenone2571-39-361 % similar 2,4-Dimethylbenzophenone1140-14-361 % similar 2,5-Dimethylbenzophenone4044-60-461 % similar 3-Bromobenzophenone1016-77-960 % similar 3-Chlorobenzophenone1016-78-060 % similar 1,4-Dibenzoylbenzene3016-97-560 % similar

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

Same formula

2′-Methyl[1,1′-biphenyl]-4-carboxaldehyde108934-21-0 3-(4-Methylphenyl)benzaldehyde116470-54-3 2-Methylbenzophenone131-58-8 4-Methylbenzophenone134-84-9 trans-Stilbene oxide1439-07-2 Fluorene-9-methanol24324-17-2 2-Phenylacetophenone451-40-1 4-Phenoxystyrene4973-29-9

Elsewhere

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