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CS-W001157 4
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5-Fluoro-6-methylnicotinic acid

  • CAS No. 932705-78-7

  • Cat. No. CS-0043478
  • Purity≥98%
  • MDL No.None

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

5-Fluoro-6-methylnicotinic acid|CS-0043478

Structure of 932705-78-7

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General Information

  • CAS No. 932705-78-7
  • Cat. No. CS-0043478
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆FNO₂
  • Molecular Weight 155.13
  • Synonym(s) 5-fluoro-6-methylpyridine-3-carboxylic acid
  • SMILES O=C(C1=CC(F)=C(C)N=C1)O

Description

5-Fluoro-6-methylnicotinic acid is a fluorinated nicotinic acid derivative featuring a methoxy group at the 6-position and a fluorine atom at the 5-position. This electron-deficient aromatic scaffold integrates readily into bioactive molecules, offering enhanced metabolic stability and improved membrane permeability in medicinal chemistry applications.

Application

5-Fluoro-6-methylnicotinic acid serves as a valuable building block in medicinal chemistry, enabling the synthesis of bioactive heterocycles and pharmaceutical intermediates. Its ortho-fluoro and methyl substituents confer enhanced metabolic stability and modulate electronic properties, facilitating downstream functionalization via coupling reactions, amidation, or cyclization. The compound exhibits good bench stability and is readily purified by recrystallization, supporting scalable synthesis and integration into standard synthetic workflows.

Synthesis

  • Route1

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GMBH; GINN, John David; MARSHALL, Daniel Richard; PROKOPOWICZ, Anthony S.; SCHYLER, Sabine; SIBLEY, Robert; TURNER, Michael Robert; WU, Di; WU, Frank Patent: WO2010/126851 A1, 2010 ; Location in patent: Page/Page column 109-110 ; WO 2010/126851 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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   1.22732
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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