1,3-Dibenzoylbenzene

C20H14O2CAS 3770-82-9286.33 g/mol

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OO
Ketone

Properties

Molecular formula
C20H14O2
Molar mass
286.33 g/mol
Exact mass
286.0994 Da
Melting point
98 °C
logP
4.15Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
3770-82-9
SMILES
O=C(c1ccccc1)c1cccc(C(=O)c2ccccc2)c1
InChIKey
MJQHDSIEDGPFAM-UHFFFAOYSA-N
InChI
InChI=1S/C20H14O2/c21-19(15-8-3-1-4-9-15)17-12-7-13-18(14-17)20(22)16-10-5-2-6-11-16/h1-14H

Weigh it out

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

Names and synonyms

11 names
  • Methanone, 1,1′-(1,3-phenylene)bis[1-phenyl-
  • Benzene, m-dibenzoyl-
  • Methanone, 1,3-phenylenebis[phenyl-
  • 1,1′-(1,3-Phenylene)bis[1-phenylmethanone]
  • m-Benzoylbenzophenone
  • m-Dibenzoylbenzene
  • 3-Benzoylbenzophenone
  • NSC 43091
  • NSC 631642
  • 1,3-Phenylenebis(phenylmethanone)
  • (3-Benzoylphenyl)-phenylmethanone

Work with 1,3-Dibenzoylbenzene

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

1,3,5-Tribenzoylbenzene25871-69-685 % similar Benzophenone119-61-979 % similar 3-Benzoylbenzoic acid579-18-073 % similar 3-Bromobenzophenone1016-77-972 % similar 3-Chlorobenzophenone1016-78-072 % similar 3-Fluorobenzophenone345-69-772 % similar 3-Methylbenzophenone643-65-272 % similar 3-Hydroxybenzophenone13020-57-069 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2-Dibenzoylbenzene1159-86-0 (+)-BINOL18531-94-7 (-)-Binol18531-99-2 1,4-Dibenzoylbenzene3016-97-5 1,1′-Bi-2-naphthol602-09-5

Elsewhere

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