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CS-W001157 4
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1-Benzyl-5-nitro-1H-indole

  • CAS No. 65795-95-1

  • Cat. No. CS-0331462
  • Purity≥97%
  • MDL No.MFCD03206550

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

1-Benzyl-5-nitro-1H-indole|CS-0331462

Structure of 65795-95-1

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General Information

  • CAS No. 65795-95-1
  • Cat. No. CS-0331462
  • Purity ≥97%
  • MDL No. MFCD03206550
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₂N₂O₂
  • Molecular Weight 252.27
  • Synonym(s) 1-Benzyl-5-nitroindol
  • SMILES C1=CC=C(C=C1)CN2C=CC3=CC(=CC=C32)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      1429616-72-7
    • ~62%
    • In-stock
      1-Benzyl-5-nitro-1H-indole|CS-0331462
      65795-95-1

    References

    • Sun, Nan; Hong, Lingfen; Huang, Fang; Ren, Hong; Mo, Weimin; Hu, Baoxiang; Shen, Zhenlu; Hu, Xinquan Tetrahedron, 2013 , vol. 69, # 19 p. 3927 - 3933
  • Route2

    References

    • Shieh, Wen-Chung; Lozanov, Mario; Loo, Mauricio; Repic, Oljan; Blacklock, Thomas J. Tetrahedron Letters, 2003 , vol. 44, # 24 p. 4563 - 4565
  • Route3

    References

    • Gurkan, A. Selen; Karabay, Arzu; Buyukbingol, Zeliha; Adejare, Adeboye; Buyukbingol, Erdem Archiv der Pharmazie, 2005 , vol. 338, # 2-3 p. 67 - 73

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   48.07
  • LogP   3.5978
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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