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CS-W001157 4
Total: USD 88.00

6-(Difluoromethyl)nicotinic acid

  • CAS No. 913091-98-2

  • Cat. No. CS-0094705
  • Purity≥98%
  • MDL No.MFCD16621992

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

6-(Difluoromethyl)nicotinic acid|CS-0094705

Structure of 913091-98-2

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General Information

  • CAS No. 913091-98-2
  • Cat. No. CS-0094705
  • Purity ≥98%
  • MDL No. MFCD16621992
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅F₂NO₂
  • Molecular Weight 173.12
  • Synonym(s) 6-(difluoromethyl)pyridine-3-carboxylic acid
  • SMILES O=C(C1=CC=C(C(F)F)N=C1)O

Description

6-(Difluoromethyl)nicotinic acid features a strategically positioned difluoromethyl group at the 6-position of the nicotinic acid scaffold, enhancing metabolic stability and modulating electronic properties. This electron-deficient heterocycle integrates readily into bioactive molecules, serving as a key building block for pharmaceuticals targeting kinase pathways and CNS disorders.

Application

6-(Difluoromethyl)nicotinic acid serves as a valuable building block for medicinal chemistry and agrochemical research, enabling the introduction of a lipophilic difluoromethyl group at the C6 position of the pyridine ring. Its stability under standard reaction conditions and compatibility with common coupling protocols facilitate efficient incorporation into diverse heterocyclic scaffolds. The molecule functions as a key intermediate in the synthesis of bioactive compounds where modulated metabolic stability and enhanced membrane permeability are desired.

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-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   1.7174
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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