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1,3-Diphenylacetone

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CAS:102-04-5
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CAS:102-04-5
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1,3-Diphenylacetone Basic information
Product Name:1,3-Diphenylacetone
Synonyms:1,3-diphenyl-2-propanon;1,3-Diphenylpropanone;2-Oxo-1,3-diphenylpropane;2-Propanone,1,3-diphenyl-;alpha,alpha'-Diphenylacetone;propanone,1,3-diphenyl-;sym-Diphenylacetone;1,3-DIPHENYLACETONE
CAS:102-04-5
MF:C15H14O
MW:210.27
EINECS:203-000-0
Product Categories:Aromatic Ketones (substituted);Pyridines
Mol File:102-04-5.mol
1,3-Diphenylacetone Structure
1,3-Diphenylacetone Chemical Properties
Melting point 32-34 °C(lit.)
Boiling point 330 °C(lit.)
density 1.04
refractive index 1.5725 (estimate)
FEMA 2397 | 1,3-DIPHENYL-2-PROPANONE
Fp >230 °F
storage temp. Keep in dark place,Sealed in dry,Room Temperature
solubility Chloroform (Slightly), Methanol (Slightly)
form Liquid or Crystalline Mass
color Clear yellow
Odorat 10.00 % in dipropylene glycol. bitter almond benzaldehyde plastic seedy
Odor Typepowdery
Water Solubility Slightly soluble in water.
JECFA Number832
BRN 974767
Stability:Stable. Combustible. Incompatible with strong oxidizing agents.
LogP3.18
CAS DataBase Reference102-04-5(CAS DataBase Reference)
NIST Chemistry Reference2-Propanone, 1,3-diphenyl-(102-04-5)
EPA Substance Registry System2-Propanone, 1,3-diphenyl- (102-04-5)
Safety Information
Safety Statements 24/25-22
WGK Germany 3
RTECS EC2030000
TSCA Yes
HS Code 29143990
MSDS Information
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1,3-Diphenylacetone Usage And Synthesis
Chemical Properties1,3-Diphenyl-2-propanone has a sweet, faint, fruity odor reminiscent of bitter almond
Physical propertiesWhite crystals or colorless crystalline mass. M.P. 40°C. B.P. 331°C.
1,3-Diphenylacetone is almost insoluble in water, soluble in alcohol and oils, poorly in Propylent glycol. Sweet, but rathtr faint, fruity-almondy odor of considerable tenacity.
Uses1,3-Diphenylacetone is used in the aldol condensation reaction with benzil (a dicarbonyl) and base to create tetraphenylcyclopentadienone.
PreparationBy heating α,?α’-phenyl benzyl ethylene glycol or α,?α’-phenyl benzyl ethylene oxide in the presence of diluted H2SO4 or ZnCl2; also by dry distillation of phenylacetate and magnesium chloride (C6H5CH2COOMgCl) or other salts of phenylacetic acid.
Application1,3-Diphenylacetone is occasionally used as a trace ingredient in floral perfums compositions, Fougere types, New Mown Hay, etc. wh:re it can act as a modifier for Coumarin, making its odor softer.
Used in fruit flavor compositions, and in imitation Honey, Nut, etc. - mostly in tracss only.
DefinitionChEBI: 1,3-Diphenyl-2-propanone is an aromatic compound.
Aroma threshold valuesAroma characteristics at 10% in ethanol. Sweet, powdery, and honey with floral rose nuances
Taste threshold valuesTaste characteristics at 30 ppm: bitter with floral, rose and honey notes.
Synthesis Reference(s)The Journal of Organic Chemistry, 33, p. 869, 1968 DOI: 10.1021/jo01266a094
Purification MethodsFractionally crystallise it from its melt, then crystallise it from pet ether. Store it in the dark. [Beilstein 7 IV 1420.]
Tag:1,3-Diphenylacetone(102-04-5) Related Product Information
Zinc dibenzyldithiocarbamate Dipropylene glycol monomethyl ether PHENCYCLONE Fluridone DIPHENYLCYCLOPROPENONE FLURTAMONE Fluorescamine Tetraphenylcyclopentadienone 1,3-Diphenylacetone 1,3-DIPHENYLPROPANETRIONE 1,1-Diphenylacetone, 99+%,UNSYM-DIPHENYLACETONE,1,1-DIPHENYLACETONE 1,3-DIPHENYLACETONE P-TOLUENESULFONYLHYDRAZONE 3-BROMO-1,1-DIPHENYLACETONE,3-Bromo-1,1-diphenylacetone, 90+% 1,3-Diphenylacetone oxime Acetone Propane Phenylacetone P-ANISYL BENZYL KETONE

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