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HomeProduct name listACETOXYACETONE

ACETOXYACETONE

Synonym(s):Acetonyl acetate

  • CAS NO.:592-20-1
  • Empirical Formula: C5H8O3
  • Molecular Weight: 116.12
  • MDL number: MFCD00042848
  • EINECS: 209-746-3
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-05-25 18:01:09
ACETOXYACETONE Structural

What is ACETOXYACETONE?

Chemical properties

Clear pale yellow to amber liquid

The Uses of ACETOXYACETONE

Acetoxyacetone is an building block in the synthesis of various pharmaceutical and organic compounds.

Definition

ChEBI: Acetoxyacetone is a carboxylic ester and a ketone.

Synthesis Reference(s)

The Journal of Organic Chemistry, 57, p. 4263, 1992 DOI: 10.1021/jo00041a036

Purification Methods

Distil it in a vacuum, then redistil it at atmospheric pressure. It is miscible with H2O, but is slowly decomposed by it. Store it in a dry atmosphere. The 2,4-dinitrophenylhydrazone has m 115-115.5o (from CHCl3/hexane). [Perkin Jr J Chem Soc 59 789 1891, Reich & Samuels J Org Chem 21 68 1956, Nef Justus Liebigs Ann Chem 335 260 1904, Beilstein 2 IV 297.]

Properties of ACETOXYACETONE

Melting point: 74.0-75.5 °C
Boiling point: 174-176 °C(lit.)
Density  1.075 g/mL at 20 °C(lit.)
refractive index  n20/D 1.415
Flash point: 71 °C
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  Soluble in diethyl ether, ethyl acetate and dichloromethane.
form  Liquid
color  Clear pale yellow to amber
Odor fruity buttery dairy nutty
BRN  1749857
CAS DataBase Reference 592-20-1(CAS DataBase Reference)
EPA Substance Registry System 2-Propanone, 1-(acetyloxy)- (592-20-1)

Safety information for ACETOXYACETONE

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H227:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P370+P378:In case of fire: Use … for extinction.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

Computed Descriptors for ACETOXYACETONE

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