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CS-W001157 4
Total: USD 88.00

2-Chloro-6-(trifluoromethyl)pyridine

  • CAS No. 39890-95-4

  • Cat. No. CS-W002204
  • Purity≥96%
  • MDL No.MFCD00042226

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

2-Chloro-6-(trifluoromethyl)pyridine|CS-W002204

Structure of 39890-95-4

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General Information

  • CAS No. 39890-95-4
  • Cat. No. CS-W002204
  • Purity ≥96%
  • MDL No. MFCD00042226
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃ClF₃N
  • Molecular Weight 181.54
  • Synonym(s) 2-Chloro-5-trifluoromethylpyri
  • SMILES ClC1=CC=CC(C(F)(F)F)=N1

Description

Bupropion HC is used as an inhibitor of dopamine and SLC6A2. Bupropion is efficacious as an antidepressant because of its effects on nicotinic receptors, it is also used to promote smoking cessation.

Application

2-Chloro-6-(trifluoromethyl)pyridine serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its activated C–Cl bond. The trifluoromethyl group enhances metabolic stability and lipophilicity, while the pyridine core provides a handle for further functionalization. Its bench-stable solid form facilitates handling and purification, making it well-suited for iterative synthesis of heterocyclic scaffolds and API intermediates.

Synthesis

  • Route1

    References

    • Cottet, Fabrice; Schlosser, Manfred European Journal of Organic Chemistry, 2002 , # 2 p. 327 - 330
  • Route2

    References

    • Cottet, Fabrice; Schlosser, Manfred European Journal of Organic Chemistry, 2002 , # 2 p. 327 - 330
  • Route3

    References

    • Cottet, Fabrice; Schlosser, Manfred European Journal of Organic Chemistry, 2002 , # 2 p. 327 - 330

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H300-H319
Precautionary Statements : P264-P270-P280-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   12.89
  • LogP   2.7538
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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