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Structure

2-Acetylimidazole

CAS
53981-69-4
Catalog Number
ACM53981694
Category
Other Products
Molecular Weight
110.11394
Molecular Formula
C5H6N2O

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Specification

Synonyms
2-Acetylimidazole;1-(1H-Imidazol-2-yl)ethanone
IUPAC Name
1-(1H-imidazol-2-yl)ethanone
Canonical SMILES
CC(=O)C1=NC=CN1
InChI Key
OSMJIXXVEWORDJ-UHFFFAOYSA-N
Boiling Point
269.4ºC at 760mmHg
Flash Point
120.8ºC
Density
1.19g/cm³
Exact Mass
146.02500
H-Bond Acceptor
2
H-Bond Donor
1

Upstream Synthesis Route 1

  • 22098-61-9
  • 53981-69-4

Reference: [1]Journal of the Chemical Society,1963,p. 2195,2197

Upstream Synthesis Route 2

  • 2466-76-4
  • 53981-69-4
  • 61985-25-9

Reference: [1]Bulletin des Societes Chimiques Belges,1984,vol. 93,p. 1067 - 1072
[2]Patent: US4374843,1983,A

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