chempirical

2-Acetylpyrrole

C6H7NOCAS 1072-83-9109.13 g/mol

Open in Covalent MOL file
OHN
Ketone

Properties

Molecular formula
C6H7NO
Molar mass
109.13 g/mol
Exact mass
109.0528 Da
Melting point
90 °C
Boiling point
220 °C
logP
1.22Crippen estimate
Polar surface area
32.9 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
1072-83-9
SMILES
CC(=O)c1ccc[nH]1
InChIKey
IGJQUJNPMOYEJY-UHFFFAOYSA-N
InChI
InChI=1S/C6H7NO/c1-5(8)6-3-2-4-7-6/h2-4,7H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

15 names · show all
  • Ethanone, 1-(1H-pyrrol-2-yl)-
  • Ketone, methyl pyrrol-2-yl
  • Ketone, methyl 2-pyrryl
  • 1-(1H-Pyrrol-2-yl)ethanone
  • Methyl pyrrol-2-yl ketone
  • 1-(2-Pyrrolyl)-1-ethanone
  • 2-Pyrrolyl methyl ketone
  • (2-Pyrrolyl)ethanone
  • 2-Acetyl-1H-pyrrole
  • NSC 42861
  • 2-Acetyl-1H-indole
  • 1-(1H-Pyrrole-2-yl)ethanone
  • 1H-Pyrrol-2-yl methyl ketone
  • 1-(1H-Pyrrol-2-yl)ethan-1-one
  • 1-(Pyrrol-2-yl)ethanone

Work with 2-Acetylpyrrole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Same formula

2-Hydroxy-3-methylpyridine1003-56-1 4-Methylpyridine N-oxide1003-67-4 2-Hydroxy-5-methylpyridine1003-68-5 3-Methylpyridine N-oxide1003-73-2 3-Pyridinemethanol100-55-0 Phenylhydroxylamine100-65-2 3-Acetylpyrrole1072-82-8 3-Hydroxy-4-methylpyridine1121-19-3

Elsewhere

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