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CS-W001157 4
Total: USD 88.00

3-(Trifluoromethyl)quinoxalin-2(1H)-one

  • CAS No. 58457-64-0

  • Cat. No. CS-0465909
  • Purity≥98%
  • MDL No.MFCD00275307

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

3-(Trifluoromethyl)quinoxalin-2(1H)-one|CS-0465909

Structure of 58457-64-0

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General Information

  • CAS No. 58457-64-0
  • Cat. No. CS-0465909
  • Purity ≥98%
  • MDL No. MFCD00275307
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅F₃N₂O
  • Molecular Weight 214.14
  • Synonym(s) 3-(Trifluoromethyl)quinoxalin-2-ol
  • SMILES C1=CC=C2C(=C1)N=C(C(=O)N2)C(F)(F)F

Synthesis

  • Route1
    • In-stock
      Ethyl trifluoropyruvate|CS-W002381
      13081-18-0
    • null|null
      95-54-5
    • ~83%
    • In-stock
      3-(Trifluoromethyl)quinoxalin-2(1H)-one|CS-0465909
      58457-64-0

    References

    • Murthy, Sabbavarapu Narayana; Madhav, Bandaru; Nageswar, Yadavalli Venkata Durga Helvetica Chimica Acta, 2010 , vol. 93, # 6 p. 1216 - 1220
  • Route2
    • null|null
      428-59-1
    • null|null
      95-54-5
    • ~%
    • In-stock
      3-(Trifluoromethyl)quinoxalin-2(1H)-one|CS-0465909
      58457-64-0

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 10, # 15 p. 1729 - 1731
  • Route3
    • null|null
      10321-14-9
    • null|null
      95-54-5
    • ~96%
    • In-stock
      3-(Trifluoromethyl)quinoxalin-2(1H)-one|CS-0465909
      58457-64-0

    References

    • Mustafa, Mohamed El-Said; Takaoka, Akio; Ishikawa, Nobuo Bulletin de la Societe Chimique de France, 1986 , # 6 p. 944 - 954

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-H412
Precautionary Statements : P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   45.75
  • LogP   1.9419
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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