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CS-W001157 4
Total: USD 88.00

2-(2,2,2-Trifluoroethanesulfonyl)acetic acid

  • CAS No. 57008-25-0

  • Cat. No. CS-0235386
  • Purity≥95%
  • MDL No.None

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

2-(2,2,2-Trifluoroethanesulfonyl)acetic acid|CS-0235386

Structure of 57008-25-0

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General Information

  • CAS No. 57008-25-0
  • Cat. No. CS-0235386
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₅F₃O₄S
  • Molecular Weight 206.14
  • Synonym(s) 2-(2,2,2-trifluoroethylsulfonyl)acetic acid
  • SMILES O=C(O)CS(=O)(CC(F)(F)F)=O

Synthesis

  • Route1
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      60543-36-4
    • ~%
    • 2-(2,2,2-Trifluoroethanesulfonyl)acetic acid|CS-0235386
      57008-25-0

    References

    • DeMarinis; Boehm; Dunn; Hoover; Uri; Guarini; Phillips; Actor; Weisbach Journal of Medicinal Chemistry, 1977 , vol. 20, # 1 p. 30 - 35

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   71.44
  • LogP   0.0481
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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