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Substance Name: Acetoxyacetone
RN: 592-20-1
UNII: CM71768T6Q
InChIKey: DBERHVIZRVGDFO-UHFFFAOYSA-N

Molecular Formula

  • C5-H8-O3

Molecular Weight

  • 116.115
 
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Names and Synonyms

Name of Substance

  • Acetoxyacetone

Synonyms

  • 1-Acetoxy-2-propanone
  • 1-Acetoxyacetone
  • 1-Hydroxy-2-propanone acetate
  • 2-Oxopropyl acetate
  • Acetol acetate
  • Acetonyl acetate
  • Acetoxyacetone
  • Acetoxypropanone
  • Acetylmethyl acetate
  • AI3-08537
  • EINECS 209-746-3
  • NSC 2298
  • NSC 7614
  • O-Acetylacetol
  • UNII-CM71768T6Q

Systematic Names

  • 2-Propanone, 1-(acetyloxy)-
  • 2-Propanone, 1-hydroxy-, acetate (8CI)
  • Acetonyl acetate

Registry Numbers

CAS Registry Number

  • 592-20-1

FDA UNII

  • CM71768T6Q

System Generated Number

  • 0000592201

Structure Descriptors

InChI

1S/C5H8O3/c1-4(6)3-8-5(2)7/h3H2,1-2H3

InChIKey

DBERHVIZRVGDFO-UHFFFAOYSA-N

Smiles

C(COC(C)=O)(C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 171 deg C   EXP
log P (octanol-water) -0.190 (none)   EST
Atmospheric OH Rate Constant 1.27E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.