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CS-W001157 4
Total: USD 88.00

1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-ol

  • CAS No. 122431-37-2

  • Cat. No. CS-0102859
  • Purity≥98%
  • MDL No.MFCD00139833

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

1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-ol|CS-0102859

Structure of 122431-37-2

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General Information

  • CAS No. 122431-37-2
  • Cat. No. CS-0102859
  • Purity ≥98%
  • MDL No. MFCD00139833
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₅F₃N₂O
  • Molecular Weight 166.10
  • Synonym(s) 5-HYDROXY-1-METHYL-3-TRIFLUOROMETHYL-1H-PYRAZOLE
  • SMILES OC1=CC(C(F)(F)F)=NN1C

Synthesis

  • Route1
    • null|null
      372-31-6
    • null|null
      60-34-4
    • ~89%
    • In-stock
      1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-ol|CS-0102859
      122431-37-2

    References

    • Hoffmann-La Roche Inc.; Alam, Muzaffar; Du Bois, Daisy Joe; Hawley, Ronald Charles; Bhagirath, Niala; Kennedy-Smith, Joshua; Wilhelm, Robert Stephen Patent: US2013/158049 A1, 2013 ; Location in patent: Paragraph 0143 ;
  • Route2
    • null|null
      944546-18-3
    • null|null
      60-34-4
    • ~97%
    • In-stock
      1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-ol|CS-0102859
      122431-37-2

    References

    • KALYPSYS, INC. Patent: WO2007/84868 A2, 2007 ; Location in patent: Page/Page column 26 ; WO 2007/084868 A2
  • Route3
    • null|null
      372-31-6
    • null|null
      60-34-4
    • ~47%
    • In-stock
      1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-ol|CS-0102859
      122431-37-2
    • In-stock
      1-Methyl-5-trifluoromethyl-1,2-dihydropyrazol-3-one|CS-0006552
      119022-51-4

    References

    • Journal of Heterocyclic Chemistry, , vol. 27, # 2 p. 243 - 245

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-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   1.1445
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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