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5-Chloro-3-(trifluoromethyl)pyridin-2(1H)-one

  • CAS No. 1214342-70-7

  • Cat. No. CS-0101617
  • Purity≥97%
  • MDL No.MFCD13185452

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

5-Chloro-3-(trifluoromethyl)pyridin-2(1H)-one|CS-0101617

Structure of 1214342-70-7

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General Information

  • CAS No. 1214342-70-7
  • Cat. No. CS-0101617
  • Purity ≥97%
  • MDL No. MFCD13185452
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃ClF₃NO
  • Molecular Weight 197.54
  • Synonym(s) 5-Chloro-3-(trifluoromethyl)pyridin-2-ol
  • SMILES O=C1C(C(F)(F)F)=CC(Cl)=CN1

Description

5-Chloro-3-(trifluoromethyl)pyridin-2(1H)-one features a strategically positioned chloro and trifluoromethyl group on a pyridinone scaffold, delivering enhanced electrophilicity and metabolic stability. This electron-deficient heterocycle integrates readily into medicinal chemistry campaigns, serving as a key building block for kinase inhibitors and bioactive small molecules under standard conditions.

Application

5-Chloro-3-(trifluoromethyl)pyridin-2(1H)-one serves as a versatile building block in medicinal chemistry, enabling direct functionalization at the C5 position via palladium-catalyzed cross-coupling. The trifluoromethyl group enhances metabolic stability and lipophilicity, while the pyridinone core provides a rigid, hydrogen-bond-capable scaffold suitable for targeted interactions. Bench-stable and compatible with standard purification methods, it facilitates efficient synthesis of kinase inhibitors and other bioactive heterocycles.

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   32.86
  • LogP   2.0471
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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