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CS-W001157 4
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2-(isopropylamino)-6-(trifluoromethyl)pyrimidin-4(1H)-one

  • CAS No. 339011-06-2

  • Cat. No. CS-0451280
  • Molecule weight221.18
  • Purity≥98%
  • MDL No.None

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

2-(isopropylamino)-6-(trifluoromethyl)pyrimidin-4(1H)-one|CS-0451280

Structure of 339011-06-2

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General Information

  • CAS No. 339011-06-2
  • Cat. No. CS-0451280
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀F₃N₃O
  • Molecular Weight 221.18
  • Synonym(s) 4-Hydroxy-2-(isopropylamino)-6-(trifluoromethyl)pyrimidine
  • SMILES O=C1N=C(NC(=C1)C(F)(F)F)NC(C)C

Synthesis

  • Route1
    • null|null
      372-31-6
    • 1-(Propan-2-yl)guanidine|CS-0745003
      42771-39-1
    • ~%
    • 2-(isopropylamino)-6-(trifluoromethyl)pyrimidin-4(1H)-one|CS-0451280
      339011-06-2

    References

    • Chai, Baoshan; Wang, Shuyang; Yu, Wenquan; Li, Huichao; Song, Chuanjun; Xu, Ying; Liu, Changling; Chang, Junbiao Bioorganic and Medicinal Chemistry Letters, 2013 , vol. 23, # 12 p. 3505 - 3510

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

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Computational Chemistry Data

  • TPSA   57.78
  • LogP   1.609
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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