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CS-W001157 4
Total: USD 88.00

Methyl 5-methoxynicotinate

  • CAS No. 29681-46-7

  • Cat. No. CS-0046214
  • Purity≥98%
  • MDL No.MFCD09265109

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

Methyl 5-methoxynicotinate|CS-0046214

Structure of 29681-46-7

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General Information

  • CAS No. 29681-46-7
  • Cat. No. CS-0046214
  • Purity ≥98%
  • MDL No. MFCD09265109
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₃
  • Molecular Weight 167.16
  • Synonym(s) Methyl 5-Mtehoxy-3-Pyridinecarboxylate
  • SMILES COC(=O)C1=CN=CC(OC)=C1

Description

Methyl 5-methoxynicotinate features a pyridine core with strategically positioned methoxy and ester groups, delivering enhanced solubility and stability under standard bench conditions. This electron-rich heterocycle integrates readily into synthetic sequences requiring polar, bench-stable intermediates for medicinal chemistry applications.

Application

Methyl 5-methoxynicotinate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to pyridine-based scaffolds. Its ester functionality facilitates nucleophilic acyl substitution and reduction reactions, while the methoxy group enhances solubility and stability. This compound functions reliably in coupling protocols and heterocycle synthesis, offering predictable reactivity for medicinal chemistry and process development workflows.

Synthesis

  • Route1
    • null|null
      74-88-4
    • ~%
    • In-stock
      Methyl 5-methoxynicotinate|CS-0046214
      29681-46-7

    References

    • WO2004/63197 A1, ; Page 254-255 ;
  • Route2

    References

    • WO2007/67511 A2, ; Page/Page column 34 ; WO 2007/067511 A2
  • Route3
    • In-stock
      Methyl 5-hydroxynicotinate|CS-W001532
      30766-22-4
    • null|null
      74-88-4
    • ~32%
    • In-stock
      Methyl 5-methoxynicotinate|CS-0046214
      29681-46-7

    References

    • Khanna; Yu; Huff; Weier; Xu; Koszyk; Collins; Cogburn; Isakson; Koboldt; Masferrer; Perkins; Seibert; Veenhuizen; Yuan; Yang; Zhang Journal of Medicinal Chemistry, 2000 , vol. 43, # 16 p. 3168 - 3185

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   48.42
  • LogP   0.8768
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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