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CS-W001157 4
Total: USD 88.00

4-(Trifluoromethyl)-1H-pyrazole

  • CAS No. 52222-73-8

  • Cat. No. CS-W004212
  • Purity≥98%
  • MDL No.MFCD11226572

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

4-(Trifluoromethyl)-1H-pyrazole|CS-W004212

Structure of 52222-73-8

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General Information

  • CAS No. 52222-73-8
  • Cat. No. CS-W004212
  • Purity ≥98%
  • MDL No. MFCD11226572
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₃F₃N₂
  • Molecular Weight 136.08
  • Synonym(s) None
  • SMILES FC(F)(F)C1=CNN=C1

Description

2,4-Dimethylbenzaldehyde is a common intermediate in the synthesis of various organic compounds, including pharmaceuticals, agrochemicals, and dyes. It is also used as a flavoring agent in food and beverages. In addition, 2,4-Dimethylbenzaldehyde has been studied as a potential therapeutic agent for the treatment of certain types of cancer. It has been shown to inhibit the growth of certain cancer cell lines, and may also have anti-inflammatory properties.

Synthesis

  • Route1
    • null|null
      460-40-2
    • null|null
      3724-43-4
    • ~29%
    • In-stock
      4-(Trifluoromethyl)-1H-pyrazole|CS-W004212
      52222-73-8

    References

    • Piotrowski, David W.; Rogers, Bruce N.; McWhorter JR., William W.; Walker, Daniel Patrick; Corbett, Jeffrey W.; Groppi JR., Vincent E.; Rudmann, Daniel G. Patent: US2003/236287 A1, 2003 ; Location in patent: Page 37 ; US 20030236287 A1
  • Route2
    • null|null
      176214-18-9
    • ~%
    • In-stock
      4-(Trifluoromethyl)-1H-pyrazole|CS-W004212
      52222-73-8

    References

    • Yamanaka, Hiroki; Takekawa, Tadashi; Morita, Kenji; Ishihara, Takashi; Gupton, John T. Tetrahedron Letters, 1996 , vol. 37, # 11 p. 1829 - 1832

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   28.68
  • LogP   1.4285
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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