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CS-W001157 4
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(6-Chloro-5-(trifluoromethyl)pyridin-3-yl)methanol

  • CAS No. 1113049-91-4

  • Cat. No. CS-0186093
  • Molecule weight211.57
  • Purity≥97%
  • MDL No.None

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

(6-Chloro-5-(trifluoromethyl)pyridin-3-yl)methanol|CS-0186093

Structure of 1113049-91-4

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General Information

  • CAS No. 1113049-91-4
  • Cat. No. CS-0186093
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅ClF₃NO
  • Molecular Weight 211.57
  • Synonym(s) 2-Chloro-3-(trifluoromethyl)-5-hydroxymethylpyridine
  • SMILES C1=C(C=NC(=C1C(F)(F)F)Cl)CO

Description

This trifluoromethyl-substituted pyridinyl methanol features a reactive alcohol group flanked by electron-withdrawing chlorine and trifluoromethyl moieties, enabling efficient coupling in cross-coupling and functionalization reactions.

Application

(6-Chloro-5-(trifluoromethyl)pyridin-3-yl)methanol serves as a versatile building block in medicinal chemistry, enabling efficient access to functionalized pyridine scaffolds. The pendant alcohol facilitates derivatization via esterification, etherification, or oxidation to aldehyde, while the chloro and trifluoromethyl groups provide orthogonal reactivity for cross-coupling and nucleophilic substitution. Its bench-stable nature and compatibility with standard synthetic protocols make it well-suited for modular synthesis of bioactive compounds.

Synthesis

  • Route1

    References

    • WO2009/18656 A1, ; Page/Page column 67 ;
  • Route2

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GmbH Patent: WO2009/18656 A1, 2009 ; Location in patent: Page/Page column 67 ;

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   33.12
  • LogP   2.2461
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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