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Total: USD 88.00

Ethyl 2-(trifluoromethyl)pyrimidine-5-carboxylate

  • CAS No. 304693-64-9

  • Cat. No. CS-0042048
  • Molecule weight220.15
  • Purity≥98%
  • MDL No.MFCD09754048

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

Ethyl 2-(trifluoromethyl)pyrimidine-5-carboxylate|CS-0042048

Structure of 304693-64-9

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General Information

  • CAS No. 304693-64-9
  • Cat. No. CS-0042048
  • Purity ≥98%
  • MDL No. MFCD09754048
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇F₃N₂O₂
  • Molecular Weight 220.15
  • Synonym(s) Ethyl 2-(trifluoromethyl)
  • SMILES O=C(C1=CN=C(C(F)(F)F)N=C1)OCC

Synthesis

  • Route1

    References

    • SmithKline Beecham p.l.c. Patent: US2004/167142 A1, 2004 ; Location in patent: Page/Page column 23 ;
  • Route2
    • Ethyl 4-hydroxy-2-(trifluoromethyl)pyrimidine-5-carboxylate|CS-0041701
      343-67-9
    • ~%
    • In-stock
      Ethyl 2-(trifluoromethyl)pyrimidine-5-carboxylate|CS-0042048
      304693-64-9

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 12, # 1 p. 51 - 55
  • Route3
    • null|null
      92385-43-8
    • null|null
      354-37-0
    • ~43%
    • In-stock
      Ethyl 2-(trifluoromethyl)pyrimidine-5-carboxylate|CS-0042048
      304693-64-9

    References

    • Palanki; Erdman; Gayo-Fung; Shevlin; Sullivan; Goldman; Ransone; Bennett; Manning; Suto Journal of medicinal chemistry, 2000 , vol. 43, # 21 p. 3995 - 4004

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.08
  • LogP   1.6721
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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