chempirical

2,4,6-Trimethylbenzophenone

C16H16OCAS 954-16-5224.30 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C16H16O
Molar mass
224.30 g/mol
Exact mass
224.1201 Da
Melting point
35 °C
Boiling point
326.5–327 °C (at 777 Torr)
logP
3.84Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
954-16-5
SMILES
Cc1cc(C)c(C(=O)c2ccccc2)c(C)c1
InChIKey
HPAFOABSQZMTHE-UHFFFAOYSA-N
InChI
InChI=1S/C16H16O/c1-11-9-12(2)15(13(3)10-11)16(17)14-7-5-4-6-8-14/h4-10H,1-3H3

Weigh it out

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

Names and synonyms

7 names
  • Methanone, phenyl(2,4,6-trimethylphenyl)-
  • Benzophenone, 2,4,6-trimethyl-
  • Phenyl(2,4,6-trimethylphenyl)methanone
  • Mesityl phenyl ketone
  • Benzoylmesitylene
  • Phenyl 2,4,6-trimethylphenyl ketone
  • NSC 26923

Work with 2,4,6-Trimethylbenzophenone

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

Dimesityl ketone5623-45-068 % similar 2,4-Dimethylbenzophenone1140-14-365 % similar 2,5-Dimethylbenzophenone4044-60-460 % similar 3-Methylbenzophenone643-65-259 % similar 4-Methylbenzophenone134-84-958 % similar 3,4-Dimethylbenzophenone2571-39-356 % similar 2-Methylbenzophenone131-58-855 % similar 3,4'-Dimethylbenzophenone13152-94-851 % similar

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

Same formula

1-[1,1′-Biphenyl]-4-yl-1-butanone13211-01-3 α-Cyclopropyl-α-phenylbenzenemethanol5785-66-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook