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CS-W001157 4
Total: USD 88.00

1-(4-(Tert-butyl)phenyl)-2,2,2-trifluoroethan-1-one

  • CAS No. 73471-97-3

  • Cat. No. CS-0455281
  • Molecule weight230.23
  • Purity≥98%
  • MDL No.None

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

1-(4-(Tert-butyl)phenyl)-2,2,2-trifluoroethan-1-one|CS-0455281

Structure of 73471-97-3

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General Information

  • CAS No. 73471-97-3
  • Cat. No. CS-0455281
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃F₃O
  • Molecular Weight 230.23
  • Synonym(s) 4'-tert-Butyl-2,2,2-trifluoroacetophenone
  • SMILES CC(C)(C)C1=CC=C(C=C1)C(=O)C(F)(F)F

Synthesis

  • Route1
    • null|null
      253185-03-4
    • 2-(Trifluoroacetoxy)Pyridine|CS-0741065
      96254-05-6
    • ~71%
    • In-stock
      1-(4-(Tert-butyl)phenyl)-2,2,2-trifluoroethan-1-one|CS-0455281
      73471-97-3

    References

    • Keumi, Takashi; Shimada, Masakazu; Takahashi, Masahiro; Kitajima, Hidehiko Chemistry Letters, 1990 , # 5 p. 783 - 786
  • Route2
    • null|null
      253185-03-4
    • null|null
      407-25-0
    • ~%
    • In-stock
      1-(4-(Tert-butyl)phenyl)-2,2,2-trifluoroethan-1-one|CS-0455281
      73471-97-3

    References

    • Journal of the American Chemical Society, , vol. 108, # 24 p. 7727 - 7738
  • Route3
    • null|null
      383-63-1
    • null|null
      63488-10-8
    • ~46%
    • In-stock
      1-(4-(Tert-butyl)phenyl)-2,2,2-trifluoroethan-1-one|CS-0455281
      73471-97-3

    References

    • Konno, Tsutomu; Takehana, Tsuyoshi; Mishima, Makoto; Ishihara, Takashi Journal of Organic Chemistry, 2006 , vol. 71, # 9 p. 3545 - 3550

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.7291
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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