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8-(Trifluoromethyl)quinoline-3-carboxylic acid

  • CAS No. 31588-79-1

  • Cat. No. CS-0197143
  • Purity≥98%
  • MDL No.None

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

8-(Trifluoromethyl)quinoline-3-carboxylic acid|CS-0197143

Structure of 31588-79-1

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General Information

  • CAS No. 31588-79-1
  • Cat. No. CS-0197143
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₆F₃NO₂
  • Molecular Weight 241.17
  • Synonym(s) 8-trifluoromethyl-quinoline-3-carboxylic acid
  • SMILES C1=CC2=CC(=CN=C2C(=C1)C(F)(F)F)C(=O)O

Description

8-(Trifluoromethyl)quinoline-3-carboxylic acid combines a sterically hindered trifluoromethyl group with a quinoline scaffold, delivering enhanced electron-withdrawing character and improved metabolic stability. This structural motif enables robust integration into pharmaceutical scaffolds and functional materials, particularly in kinase inhibitor design and photonic applications.

Application

8-(Trifluoromethyl)quinoline-3-carboxylic acid serves as a versatile building block for medicinal chemistry and materials science, leveraging the electron-withdrawing trifluoromethyl group to modulate electronic properties and metabolic stability. The quinoline core enables efficient functionalization at multiple sites, while the carboxylic acid facilitates amide coupling, esterification, or metal coordination—key transformations in API development and catalyst design. Its bench-stable crystalline form simplifies handling and purification in multi-step syntheses.

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   2.9518
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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