4-Acetylpyridine (C7H7NO)

4-Acetylpyridine (C7H7NO; CAS 1122-54-9) is a practical retrosynthesis target. 4-Acetylpyridine presents a C7 framework, aromatic rings. Open AI route search in one click below.

Target: 4-Acetylpyridine
CAS: 1122-54-9
Formula: C7H7NO
Approx. MW: 121.14
SMILES: CC(=O)c1ccncc1
PubChem CID: 14282
Approx. carbons: C7

4-Acetylpyridine structure

Properties

IUPAC name: 1-pyridin-4-ylethanone
Common names: 4-Acetylpyridine; 1122-54-9; 1-pyridin-4-ylethanone; Methyl 4-pyridyl ketone; Ethanone, 1-(4-pyridinyl)-; Ketone, methyl 4-pyridyl; Pyridine, 4-acetyl-; 4-Pyridyl methyl ketone; 1-(4-PYRIDINYL)ETHANONE; NSC-111
Molecular weight: 121.14
Exact mass: 121.05
InChIKey: WMQUKDQWMMOHSA-UHFFFAOYSA-N
Boiling point: 414 °F at 760 mmHg (NTP, 1992)
Density: 1.111 at 74.1 °F (NTP, 1992) - Denser than water; will sink

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4-Acetylpyridine 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 4-Acetylpyridine?

4-Acetylpyridine has molecular formula C7H7NO. Molecular weight about 121.14 g·mol⁻¹.

What is the CAS number of 4-Acetylpyridine?

The CAS Registry Number for 4-Acetylpyridine is 1122-54-9.

Run AI retrosynthesis for 4-Acetylpyridine Target catalog AI tools overview

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.