chempirical

Dibenzyl ketone

C15H14OCAS 102-04-5210.28 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C15H14O
Molar mass
210.28 g/mol
Exact mass
210.1045 Da
Melting point
35 °C
Boiling point
331 °C
logP
3.04Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
4

Identifiers

CAS number
102-04-5
SMILES
O=C(Cc1ccccc1)Cc1ccccc1
InChIKey
YFKBXYGUSOXJGS-UHFFFAOYSA-N
InChI
InChI=1S/C15H14O/c16-15(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2

Weigh it out

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

Names and synonyms

9 names
  • 2-Propanone, 1,3-diphenyl-
  • 1,3-Diphenyl-2-propanone
  • Benzyl ketone
  • 1,3-Diphenylacetone
  • 1,3-Diphenylpropanone
  • α,α′-Diphenylacetone
  • NSC 220312
  • NSC 407392
  • NSC 4577

Work with Dibenzyl ketone

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

1-Phenyl-2-butanone1007-32-571 % similar 4-Methyl-1-phenyl-2-pentanone5349-62-263 % similar 1-Phenyl-2-hexanone25870-62-661 % similar 2-Indanone615-13-459 % similar Phenylacetone103-79-756 % similar Phenylacetyl chloride103-80-056 % similar Phenylacetic acid103-82-256 % similar Potassium phenylacetate13005-36-254 % similar

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

Same formula

Dihydrochalcone1083-30-3 2,4-Dimethylbenzophenone1140-14-3 4-Methoxystilbene1142-15-0 Dibenzosuberol1210-34-0 3,4'-Dimethylbenzophenone13152-94-8 4-Ethylbenzophenone18220-90-1 9,9-Dimethyl-9H-xanthene19814-75-6 3,4-Dimethylbenzophenone2571-39-3

Elsewhere

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