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CS-W001157 4
Total: USD 88.00

1-(5-Methoxypyridin-3-yl)ethanone

  • CAS No. 886364-74-5

  • Cat. No. CS-0155105
  • Purity≥98%
  • MDL No.MFCD07375082

*For research and further manufacturing use only, not for direct human use.

1-(5-Methoxypyridin-3-yl)ethanone|CS-0155105

Structure of 886364-74-5

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General Information

  • CAS No. 886364-74-5
  • Cat. No. CS-0155105
  • Purity ≥98%
  • MDL No. MFCD07375082
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₂
  • Molecular Weight 151.16
  • Synonym(s) None
  • SMILES CC(=O)C1=CC(=CN=C1)OC

Description

1-(5-Methoxypyridin-3-yl)ethanone features a pyridine ring functionalized with a methoxy group at the 5-position and an acetyl moiety at the 3-position, delivering enhanced solubility and stability. This configuration enables efficient coupling in cross-coupling reactions and facilitates incorporation into bioactive scaffolds.

Application

1-(5-Methoxypyridin-3-yl)ethanone serves as a versatile building block in medicinal chemistry, enabling the construction of pyridine-based pharmacophores. Its ketone functionality supports direct functionalization via nucleophilic addition or enolization, while the methoxy group enhances solubility and modulates electronic properties. The molecule exhibits excellent bench stability and compatibility with standard synthetic protocols, facilitating efficient incorporation into diverse heterocyclic scaffolds through coupling, cyclization, or reductive amination reactions.

Synthesis

  • Route1
    • In-stock
      3-Bromo-5-methoxypyridine|CS-W007427
      50720-12-2
    • null|null
      97674-02-7
    • ~64%
    • In-stock
      1-(5-Methoxypyridin-3-yl)ethanone|CS-0155105
      886364-74-5

    References

    • IRM LLC; NOVARTIS AG; CHIANELLI, Donatella; LI, Xiaolin; LIU, Xiaodong; LOREN, Jon; MOLTENI, Valentina; NABAKKA, Juliet; REVESZ, Laszlo; PEREZ, Lawrence B.; BROOKS, Clinton; WRONA, Wojciech; MANLEY, Paul W.; BREITENSTEIN, Werner Patent: WO2008/58037 A1, 2008 ; Location in patent: Page/Page column 32 ; WO 2008/058037 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   1.2928
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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