2,6-Dimethyl-3,5-diphenyl-4H-pyran-4-one

C₁₉H₁₆O₂CAS 33731-54-3276.34 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₉H₁₆O₂
Molar mass: 276.34 g/mol
Exact mass: 276.1150 Da
logP: 4.59Crippen estimate
Polar surface area: 30.2 Å²
H-bond donors / acceptors: 0 / 2
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

33731-54-3

SMILES

CC1=C(C(=O)C(=C(O1)C)C2=CC=CC=C2)C3=CC=CC=C3

InChIKey

YCMLUTKKOKKIMN-UHFFFAOYSA-N

InChI

InChI=1S/C19H16O2/c1-13-17(15-9-5-3-6-10-15)19(20)18(14(2)21-13)16-11-7-4-8-12-16/h3-12H,1-2H3

Weigh it out

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

Names and synonyms

3 names

2,6-Dimethyl-3,5-diphenylpyran-4-one
2,6-Dimethyl-3,5-diphenyl-4-pyrone
4H-Pyran-4-one,2,6-dimethyl-3,5-diphenyl-

Reactions

2,6-DIMETHYL-3,5-DIPHENYL-4H-PYRAN-4-ONE (4H-Pyran-4-one, 2,6-dimethyl-3,5-diphenyl-)product

Work with 2,6-Dimethyl-3,5-diphenyl-4H-pyran-4-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

Diphenylcyclopropenone886-38-460 % similar 5-Methyl-3,4-diphenyl-isoxazole37928-17-944 % similar Hexaphenylbenzene992-04-140 % similar 4,5-Diphenyl-1,3-dioxol-2-one21240-34-639 % similar Rubrene517-51-138 % similar Valdecoxib181695-72-737 % similar 2-Methyl-5-phenylfuran-3-carboxylic acid108124-17-037 % similar 9,10-Diphenylanthracene1499-10-136 % similar

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

Same formula

9-Anthrylmethyl methacrylate31645-35-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook