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CS-W001157 4
Total: USD 88.00

4,4,4-Trifluorobutyric acid

  • CAS No. 406-93-9

  • Cat. No. CS-W007460
  • Purity≥97%
  • MDL No.MFCD00077604

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

4,4,4-Trifluorobutyric acid|CS-W007460

Structure of 406-93-9

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General Information

  • CAS No. 406-93-9
  • Cat. No. CS-W007460
  • Purity ≥97%
  • MDL No. MFCD00077604
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₅F₃O₂
  • Molecular Weight 142.08
  • Synonym(s) 4,4,4-Trifluoro-butyric acid
  • SMILES OC(=O)CCC(F)(F)F

Synthesis

  • Route1
    • null|null
      371-26-6
    • ~97%
    • In-stock
      4,4,4-Trifluorobutyric acid|CS-W007460
      406-93-9

    References

    • Sumitomo Chemical Company, Limited Patent: US5653990 A1, 1997 ;
  • Route2
    • null|null
      460-37-7
    • null|null
      201230-82-2
    • ~61%
    • In-stock
      4,4,4-Trifluorobutyric acid|CS-W007460
      406-93-9

    References

    • Urata, Hisao; Kosukegawa, Osamu; Ishii, Yoshimitsu; Yugary, Hideki; Fuchikami, Takamasa Tetrahedron Letters, 1989 , vol. 30, # 33 p. 4403 - 4406
  • Route3
    • null|null
      25597-16-4
    • ~82%
    • In-stock
      4,4,4-Trifluorobutyric acid|CS-W007460
      406-93-9

    References

    • ICI Americas Inc. Patent: US4552883 A1, 1985 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314-H412
Precautionary Statements : P260-P264-P273-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.4135
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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