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CS-W001157 4
Total: USD 88.00

methyl 3-hydroxyisonicotinate

  • CAS No. 10128-72-0

  • Cat. No. CS-W002652
  • Purity≥97%
  • MDL No.MFCD00661299

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

methyl 3-hydroxyisonicotinate|CS-W002652

Structure of 10128-72-0

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General Information

  • CAS No. 10128-72-0
  • Cat. No. CS-W002652
  • Purity ≥97%
  • MDL No. MFCD00661299
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇NO₃
  • Molecular Weight 153.14
  • Synonym(s) methyl 3-hydroxypyridine-4-carboxylate
  • SMILES COC(=O)c1ccncc1O

Description

Methyl 3-hydroxyisonicotinate features a pyridine ring bearing both methyl ester and hydroxyl substituents at the meta and para positions, respectively. This arrangement imparts enhanced solubility in polar organic solvents and facilitates downstream derivatization in synthetic routes. The compound exhibits stability under standard bench conditions and serves as a key intermediate in the construction of bioactive heterocycles and pharmaceutical precursors.

Application

Methyl 3-hydroxyisonicotinate serves as a versatile building block in synthetic organic chemistry, enabling the construction of pyridine-based heterocycles and bioactive scaffolds. The ortho-hydroxyl group facilitates directed metalation and subsequent functionalization, while the ester moiety supports selective transformations under mild conditions. Its bench-stable nature and compatibility with common coupling and reduction protocols make it a practical choice for medicinal chemistry and process development workflows.

Synthesis

  • Route1
    • null|null
      67-56-1
    • In-stock
      3-Hydroxypyridine-4-carboxylic acid|CS-W001841
      10128-71-9
    • ~81%
    • In-stock
      methyl 3-hydroxyisonicotinate|CS-W002652
      10128-72-0

    References

    • Hansen, Poul Erik; Kamounah, Fadhil S.; Ullah, Saif Journal of Molecular Structure, 2007 , vol. 844-845, p. 300 - 307
  • Route2

    References

    • Journal of Organic Chemistry, , vol. 17, p. 547,553

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   59.42
  • LogP   0.5738
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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