2-Acetyl-1H-Pyrrole

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Properties Simple | Detailed

Formula C6H7NO
IUPAC Name 1-(1h-pyrrol-2-yl)ethanone
Molecular Mass 109.126 g·mol−1
Heat of Formation -65.4 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 137.43 Å 3
Surface Area 145.81 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 2.85 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(1h-pyrrol-2-yl)ethan-1-one
  • 1-(1h-pyrrol-2-yl)ethanone
  • 1-(2-pyrrolyl)-1-ethanone
  • 2-acetylpyrrole
  • 2-pyrrolyl methyl ketone
  • 2-pyrrolylethanone
  • bb_sc-4064
  • ethanone, 1-(1h-pyrrol-2-yl)-
  • ketone, methyl pyrrol-2-yl
  • methyl 2-pyrrolyl ketone
  • methyl 2-pyrryl ketone
  • methyl pyrrol-2-yl ketone
  • pyrrole-b-methyl ketone
  • pyrryl-alpha-methyl ketone
  • sdccgmls-0066967.p001
CAS Number(s)
  • 1072-83-9
InChIKey IGJQUJNPMOYEJY-UHFFFAOYSA-N
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