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CS-W001157 4
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Methyl 5-fluoropicolinate

  • CAS No. 107504-07-4

  • Cat. No. CS-0018830
  • Purity≥98%
  • MDL No.MFCD11845630

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

Methyl 5-fluoropicolinate|CS-0018830

Structure of 107504-07-4

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General Information

  • CAS No. 107504-07-4
  • Cat. No. CS-0018830
  • Purity ≥98%
  • MDL No. MFCD11845630
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆FNO₂
  • Molecular Weight 155.13
  • Synonym(s) Methyl 5-Fluoropyridine-2-carboxylate
  • SMILES O=C(C1=NC=C(F)C=C1)OC

Description

Methyl 5-fluoropicolinate is a fluorinated pyridine derivative featuring a methyl ester group at the C5 position. This electron-deficient heterocycle integrates readily into synthetic routes requiring polar, bench-stable building blocks. The para-fluoro substitution enhances reactivity in nucleophilic aromatic substitution and facilitates downstream functionalization in medicinal chemistry and agrochemical development.

Application

Methyl 5-fluoropicolinate serves as a versatile building block in medicinal chemistry and synthetic organic chemistry, enabling efficient construction of bioactive heterocycles and pharmaceutical intermediates. Its fluorinated pyridine core provides enhanced metabolic stability and modulated electronic properties, while the ester functionality facilitates straightforward derivatization via hydrolysis, nucleophilic substitution, or coupling reactions. The compound exhibits excellent bench stability and is readily purified by standard chromatographic methods, making it well-suited for scalable synthesis workflows.

Synthesis

  • Route1
    • In-stock
      5-Fluoro-2-picolinic acid|CS-W003161
      107504-08-5
    • null|null
      67-56-1
    • ~%
    • In-stock
      Methyl 5-fluoropicolinate|CS-0018830
      107504-07-4

    References

    • GRAUERT, Matthias; BISCHOFF, Daniel; DAHMANN, Georg; KUELZER, Raimund; RUDOLF, Klaus Patent: US2013/137688 A1, 2013 ; Location in patent: Paragraph 0239; 0240; 0241 ;
  • Route2

    References

    • Lee, Hong Geun; Milner, Phillip J.; Buchwald, Stephen L. Journal of the American Chemical Society, 2014 , vol. 136, # 10 p. 3792 - 3795
  • Route3
    • null|null
      544-16-1
    • In-stock
      Methyl 5-aminopicolinate|CS-W009245
      67515-76-8
    • ~%
    • In-stock
      Methyl 5-fluoropicolinate|CS-0018830
      107504-07-4

    References

    • US4638068 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   1.0073
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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