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CS-W001157 4
Total: USD 88.00

1-(2,2,2-Trifluoroacetamido)cyclopropane-1-carboxylic acid

  • CAS No. 669066-98-2

  • Cat. No. CS-0130142
  • Purity≥97%
  • MDL No.MFCD20484295

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

1-(2,2,2-Trifluoroacetamido)cyclopropane-1-carboxylic acid|CS-0130142

Structure of 669066-98-2

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General Information

  • CAS No. 669066-98-2
  • Cat. No. CS-0130142
  • Purity ≥97%
  • MDL No. MFCD20484295
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆F₃NO₃
  • Molecular Weight 197.11
  • Synonym(s) Cyclopropanecarboxylic acid, 1-[(trifluoroacetyl)amino]- (9CI)
  • SMILES O=C(C1(NC(C(F)(F)F)=O)CC1)O

Synthesis

  • Route1
    • null|null
      383-63-1
    • In-stock
      1-Aminocyclopropane-1-carboxylic acid|CS-B0091
      22059-21-8
    • ~87%
    • In-stock
      1-(2,2,2-Trifluoroacetamido)cyclopropane-1-carboxylic acid|CS-0130142
      669066-98-2

    References

    • Aebi, Johannes; Binggeli, Alfred; Hertel, Cornelia; Konkar, Anish Ashok; Kuehne, Holger; Kuhn, Bernd; Maerki, Hans P.; Wang, Haiyan Patent: US2013/18055 A1, 2013 ; Location in patent: Paragraph 0287 ;
  • Route2
    • null|null
      383-63-1
    • In-stock
      1-Aminocyclopropane-1-carboxylic acid hydrochloride|CS-0003966
      68781-13-5
    • ~%
    • In-stock
      1-(2,2,2-Trifluoroacetamido)cyclopropane-1-carboxylic acid|CS-0130142
      669066-98-2

    References

    • MERCK and CO., INC. Patent: WO2005/16886 A1, 2005 ; Location in patent: Page/Page column 29 ; WO 2005/016886 A1
  • Route3
    • null|null
      848860-95-7
    • In-stock
      1-Aminocyclopropane-1-carboxylic acid|CS-B0091
      22059-21-8
    • ~90%
    • In-stock
      1-(2,2,2-Trifluoroacetamido)cyclopropane-1-carboxylic acid|CS-0130142
      669066-98-2

    References

    • Hickey, Matthew R.; Nelson, Todd D.; Secord, Elizabeth A.; Allwein, Shawn P.; Kress, Michael H. Synlett, 2005 , # 2 art. no. S09004ST, p. 255 - 258

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   0.2821
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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