chempirical

2,3-Diphenyl-1H-inden-1-one

C21H14OCAS 1801-42-9282.34 g/mol

Open in Covalent MOL file
O
AlkeneKetone

Properties

Molecular formula
C21H14O
Molar mass
282.34 g/mol
Exact mass
282.1045 Da
logP
4.84Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

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

Identifiers

CAS number
1801-42-9
SMILES
C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C32)C4=CC=CC=C4
InChIKey
POVRXYLNLVVNGW-UHFFFAOYSA-N
InChI
InChI=1S/C21H14O/c22-21-18-14-8-7-13-17(18)19(15-9-3-1-4-10-15)20(21)16-11-5-2-6-12-16/h1-14H

Weigh it out

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Names and synonyms

9 names
  • 2,3-Diphenylinden-1-one
  • 2,3-Diphenyl-1-indenone
  • 2,3-Diphenylindone
  • 2,3-Diphenyl-1-indanone
  • Indone, 2,3-diphenyl-
  • 2,3-Diphenyl-inden-1-one
  • Indone,3-diphenyl-
  • 1H-Inden-1-one,3-diphenyl-
  • 2,3-Diphenylindenone

Work with 2,3-Diphenyl-1H-inden-1-one

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

3-Amino-2-phenyl-1H-inden-1-one1947-47-361 % similar Benzil134-81-650 % similar Tetraphenylcyclopentadienone479-33-450 % similar 1,4-Bis(phenylglyoxaloyl)benzene3363-97-148 % similar 1,2-Dibenzoylbenzene1159-86-045 % similar Tetraphenylethylene632-51-944 % similar Dichlone117-80-643 % similar Bianthrone434-85-541 % similar

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

Elsewhere

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