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CS-W001157 4
Total: USD 88.00

1-(2-Nitro-4-(trifluoromethyl)phenyl)-1h-imidazole

  • CAS No. 25373-61-9

  • Cat. No. CS-0268747
  • Molecule weight257.17
  • Purity95+%
  • MDL No.None

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

1-(2-Nitro-4-(trifluoromethyl)phenyl)-1h-imidazole|CS-0268747

Structure of 25373-61-9

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General Information

  • CAS No. 25373-61-9
  • Cat. No. CS-0268747
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₆F₃N₃O₂
  • Molecular Weight 257.17
  • Synonym(s) 1-[2-nitro-4-(trifluoromethyl)phenyl]imidazole
  • SMILES C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])N2C=CN=C2

Synthesis

  • Route1

    References

    • CANCER RESEARCH TECHNOLOGY LIMITED; INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) Patent: WO2009/77766 A1, 2009 ; Location in patent: Page/Page column 196 ; WO 2009/077766 A1
  • Route2
    • Imidazole Ondansetron Impurity|CS-0229601
      288-32-4
    • null|null
      121-17-5
    • ~89%
    • 1-(2-Nitro-4-(trifluoromethyl)phenyl)-1h-imidazole|CS-0268747
      25373-61-9

    References

    • Wan, Jie-Ping; Chai, Yun-Feng; Wu, Jian-Mei; Pan, Yuan-Jiang Synlett, 2008 , # 19 p. 3068 - 3072

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   60.96
  • LogP   2.7993
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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