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CS-W001157 4
Total: USD 88.00

6-Methoxycarbonylpyridine-3-carboxylic acid

  • CAS No. 17874-76-9

  • Cat. No. CS-0035737
  • Purity≥95%
  • MDL No.MFCD09702182

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

6-Methoxycarbonylpyridine-3-carboxylic acid|CS-0035737

Structure of 17874-76-9

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General Information

  • CAS No. 17874-76-9
  • Cat. No. CS-0035737
  • Purity ≥95%
  • MDL No. MFCD09702182
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₄
  • Molecular Weight 181.15
  • Synonym(s) 6-(Methoxycarbonyl)nicotinic acid
  • SMILES COC(=O)C1=CC=C(C=N1)C(=O)O

Description

6-Methoxycarbonylpyridine-3-carboxylic acid features a pyridine core bearing both ester and carboxylic acid functionalities at positions 6 and 3, respectively. This dual-electrophilic motif enables direct incorporation into heterocyclic scaffolds via coupling reactions. The methoxycarbonyl group enhances solubility and stability under standard conditions, facilitating use in synthetic transformations requiring controlled reactivity.

Application

6-Methoxycarbonylpyridine-3-carboxylic acid serves as a versatile building block for heterocyclic synthesis, enabling efficient access to pyridine-based scaffolds relevant in medicinal chemistry. Its dual carboxylic acid and ester functionalities offer orthogonal reactivity for coupling reactions and derivatization. The molecule exhibits good bench stability and facilitates straightforward purification, making it well-suited for use in standard synthetic workflows requiring functional group tolerance and predictable reactivity.

Synthesis

  • Route1
    • null|null
      67-56-1
    • 2,5-Pyridinedicarboxylic acid Nicotinic Acid  Impurity|CS-0229402
      100-26-5
    • ~42%
    • In-stock
      6-Methoxycarbonylpyridine-3-carboxylic acid|CS-0035737
      17874-76-9

    References

    • ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA, ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY; WAGNER, Carl E.; JURUTKA, Peter W.; MARSHALL, Pamela A.; VAN DER VAART, Arjan Patent: WO2011/103321 A1, 2011 ; Location in patent: Page/Page column 23 ;
  • Route2
    • 2,5-Pyridinedicarboxylic acid Nicotinic Acid  Impurity|CS-0229402
      100-26-5
    • ~%
    • In-stock
      6-Methoxycarbonylpyridine-3-carboxylic acid|CS-0035737
      17874-76-9

    References

    • US4273779 A1, ;
  • Route3
    • 2,5-Pyridinedicarboxylic acid Nicotinic Acid  Impurity|CS-0229402
      100-26-5
    • null|null
      7664-93-9
    • ~%
    • In-stock
      6-Methoxycarbonylpyridine-3-carboxylic acid|CS-0035737
      17874-76-9

    References

    • US6479519 B1, ;

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

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Computational Chemistry Data

  • TPSA   76.49
  • LogP   0.5664
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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