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CS-W001157 4
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3-(Trifluoromethyl)pyridine-4-carboxylic acid

  • CAS No. 590371-38-3

  • Cat. No. CS-W019443
  • Purity≥98%
  • MDL No.MFCD08234940

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

3-(Trifluoromethyl)pyridine-4-carboxylic acid|CS-W019443

Structure of 590371-38-3

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General Information

  • CAS No. 590371-38-3
  • Cat. No. CS-W019443
  • Purity ≥98%
  • MDL No. MFCD08234940
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄F₃NO₂
  • Molecular Weight 191.11
  • Synonym(s) 4-pyridinecarboxylic acid, 3-(trifluoromethyl)-
  • SMILES FC(C1=C(C(=O)O)C=CN=C1)(F)F

Description

3-(Trifluoromethyl)pyridine-4-carboxylic acid features a strategically positioned trifluoromethyl group that enhances electron-withdrawal and metabolic stability. The carboxylic acid moiety enables direct coupling or salt formation, facilitating integration into pharmaceutical scaffolds. This compound serves as a key building block in the development of bioactive molecules requiring strong dipole moments and controlled solubility profiles.

Application

3-(Trifluoromethyl)pyridine-4-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling direct incorporation of a polar, electron-deficient trifluoromethylpyridine motif into target molecules. Its carboxylic acid functionality facilitates amide bond formation, esterification, and metal-catalyzed coupling reactions, while the trifluoromethyl group enhances metabolic stability and modulates electronic properties. The compound exhibits good bench stability and is compatible with standard purification techniques.

Safety Information

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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   50.19
  • LogP   1.7986
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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