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CS-W001157 4
Total: USD 88.00

1-Benzyl-4-iodo-1H-pyrazole

  • CAS No. 50877-42-4

  • Cat. No. CS-0037677
  • Molecule weight284.10
  • Purity≥98%
  • MDL No.MFCD04038745

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

1-Benzyl-4-iodo-1H-pyrazole|CS-0037677

Structure of 50877-42-4

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General Information

  • CAS No. 50877-42-4
  • Cat. No. CS-0037677
  • Purity ≥98%
  • MDL No. MFCD04038745
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉IN₂
  • Molecular Weight 284.10
  • Synonym(s) 1-benzyl-4-iodopyrazole
  • SMILES C1=CC=C(C=C1)CN2C=C(C=N2)I

Synthesis

  • Route1
    • In-stock
      4-Iodopyrazole|CS-W008950
      3469-69-0
    • null|null
      100-39-0
    • ~98%
    • In-stock
      1-Benzyl-4-iodo-1H-pyrazole|CS-0037677
      50877-42-4

    References

    • ILIAD CHEMICALS PTY LTD Patent: WO2006/84338 A1, 2006 ; Location in patent: Page/Page column 63 ;
  • Route2

    References

    • Rodriguez-Franco, Maria Isabel; Dorronsoro, Isabel; Hernandez-Higueras, Ana I; Antequera, Gema Tetrahedron Letters, 2001 , vol. 42, # 5 p. 863 - 865
  • Route3

    References

    • Palle, Venkata P.; Elzein, Elfatih O.; Gothe, Scott A.; Li, Zhihe; Gao, Zhenhai; Meyer, Stephanie; Blackburn, Brent; Zablocki, Jeff A. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 20 p. 2935 - 2939

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   17.82
  • LogP   2.536
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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