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CS-W001157 4
Total: USD 88.00

2,2,2-Trifluoro-N-hexylacetamide

  • CAS No. 687-09-2

  • Cat. No. CS-0573122
  • Molecule weight197.20
  • Purity≥98%
  • MDL No.None

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

2,2,2-Trifluoro-N-hexylacetamide|CS-0573122

Structure of 687-09-2

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General Information

  • CAS No. 687-09-2
  • Cat. No. CS-0573122
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄F₃NO
  • Molecular Weight 197.20
  • Synonym(s) N-Hexyltrifluoroacetamide
  • SMILES CCCCCCNC(=O)C(F)(F)F

Synthesis

  • Route1
    • null|null
      111-26-2
    • null|null
      76-05-1
    • ~92%
    • 2,2,2-Trifluoro-N-hexylacetamide|CS-0573122
      687-09-2

    References

    • Kim, Joong-Gon; Jang, Doo Ok Tetrahedron Letters, 2010 , vol. 51, # 4 p. 683 - 685
  • Route2
    • null|null
      111-26-2
    • 2-(Trifluoroacetoxy)Pyridine|CS-0741065
      96254-05-6
    • ~92%
    • 2,2,2-Trifluoro-N-hexylacetamide|CS-0573122
      687-09-2

    References

    • Keumi, Takashi; Shimada, Masakazu; Morita, Toshio; Kitajima, Hidehiko Bulletin of the Chemical Society of Japan, 1990 , vol. 63, # 8 p. 2252 - 2256
  • Route3
    • null|null
      111-26-2
    • ~91%
    • 2,2,2-Trifluoro-N-hexylacetamide|CS-0573122
      687-09-2

    References

    • Svirskaya, Polina I.; Leznoff, Clifford C.; Steinman, Martin Journal of Organic Chemistry, 1987 , vol. 52, # 7 p. 1362 - 1364

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   2.2452
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   5

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