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CS-W001157 4
Total: USD 88.00

2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]acetonitrile

  • CAS No. 157764-10-8

  • Cat. No. CS-0215502
  • Purity≥98%
  • MDL No.None

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

2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]acetonitrile|CS-0215502

Structure of 157764-10-8

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General Information

  • CAS No. 157764-10-8
  • Cat. No. CS-0215502
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₄ClF₃N₂
  • Molecular Weight 220.58
  • Synonym(s) 3-Chloro-5-(trifluoromethyl)-2-pyridineacetonitrile
  • SMILES C(C#N)C1=C(C=C(C=N1)C(F)(F)F)Cl

Synthesis

  • Route1
    • Methyl 2-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-2-cyanoacetate|CS-0331460
      658066-43-4
    • ~90%
    • In-stock
      2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]acetonitrile|CS-0215502
      157764-10-8

    References

    • BAYER CROPSCIENCE S.A. Patent: WO2005/58828 A1, 2005 ; Location in patent: Page/Page column 43-44 ;
  • Route2
    • In-stock
      2,3-Dichloro-5-trifluoromethylpyridine|CS-0015949
      69045-84-7
    • null|null
      105-56-6
    • ~93%
    • In-stock
      2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]acetonitrile|CS-0215502
      157764-10-8

    References

    • Bayer CropScience S.A. Patent: EP1674455 A1, 2006 ; Location in patent: Page/Page column 16 ;
  • Route3

    References

    • Huang, Charles Q.; Wilcoxen, Keith M.; Grigoriadis, Dimitri E.; McCarthy, James R.; Chen, Chen Bioorganic and Medicinal Chemistry Letters, 2004 , vol. 14, # 15 p. 3943 - 3947

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-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   36.68
  • LogP   2.81988
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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