3-Acetylpyrrole

C₆H₇NOCAS 1072-82-8109.13 g/mol

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Properties

Molecular formula: C₆H₇NO
Molar mass: 109.13 g/mol
Exact mass: 109.0528 Da
logP: 1.22Crippen estimate
Polar surface area: 32.9 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

1072-82-8

SMILES

CC(=O)C1=CNC=C1

InChIKey

KHHSXHXUQVNBGA-UHFFFAOYSA-N

InChI

InChI=1S/C6H7NO/c1-5(8)6-2-3-7-4-6/h2-4,7H,1H3

Weigh it out

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

Work with 3-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 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 2-Acetylpyrrole1072-83-9 3-Hydroxy-4-methylpyridine1121-19-3

Elsewhere

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