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CS-W001157 4
Total: USD 88.00

2-(Trifluoromethyl)pyrimidine-4-carbonitrile

  • CAS No. 916210-03-2

  • Cat. No. CS-0377281
  • Molecule weight173.10
  • Purity95+%
  • MDL No.None

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

2-(Trifluoromethyl)pyrimidine-4-carbonitrile|CS-0377281

Structure of 916210-03-2

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General Information

  • CAS No. 916210-03-2
  • Cat. No. CS-0377281
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₂F₃N₃
  • Molecular Weight 173.10
  • Synonym(s) 2-(Trifluoromethyl)-4-pyrimidinecarbonitrile
  • SMILES N#CC1=NC(C(F)(F)F)=NC=C1

Synthesis

  • Route1
    • 2-(Trifluoromethyl)pyrimidine-4-carboxamide|CS-0461827
      914348-10-0
    • ~63%
    • 2-(Trifluoromethyl)pyrimidine-4-carbonitrile|CS-0377281
      916210-03-2

    References

    • ALANTOS-PHARMACEUTICALS, INC. Patent: WO2006/128184 A2, 2006 ; Location in patent: Page/Page column 160-161 ; WO 2006/128184 A2

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   49.57
  • LogP   1.36708
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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