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CS-W001157 4
Total: USD 88.00

1-Benzyl-1H-indole

  • CAS No. 3377-71-7

  • Cat. No. CS-0206424
  • Purity≥98%
  • MDL No.MFCD00015884

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

1-Benzyl-1H-indole|CS-0206424

Structure of 3377-71-7

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General Information

  • CAS No. 3377-71-7
  • Cat. No. CS-0206424
  • Purity ≥98%
  • MDL No. MFCD00015884
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₃N
  • Molecular Weight 207.27
  • Synonym(s) 1-Benzylindole
  • SMILES C1=CC=C(C=C1)CN2C=CC3=CC=CC=C32

Description

1-Benzyl-1H-indole is a bench-stable, moisture-tolerant heterocyclic scaffold featuring a benzyl-substituted indole core. This compound integrates readily into synthetic routes for bioactive molecules, serving as a key building block in medicinal chemistry and materials science applications.

Application

1-Benzyl-1H-indole serves as a versatile building block in medicinal chemistry, enabling direct functionalization at the indole nitrogen and facilitating C3-substitution reactions. Its benzyl group enhances stability and simplifies purification, while the intact indole core supports diverse transformations including electrophilic substitution, transition-metal-catalyzed coupling, and heterocycle elaboration. This scaffold is widely employed in the synthesis of bioactive molecules and API intermediates.

Synthesis

  • Route1
    • Indole, ≥99%|CS-1268948
      120-72-9
    • null|null
      100-44-7
    • ~98%
    • In-stock
      1-Benzyl-1H-indole|CS-0206424
      3377-71-7

    References

    • Sukata, Kazuaki Bulletin of the Chemical Society of Japan, 1983 , vol. 56, # 1 p. 280 - 284
  • Route2

    References

    • Shieh, Wen-Chung; Lozanov, Mario; Loo, Mauricio; Repic, Oljan; Blacklock, Thomas J. Tetrahedron Letters, 2003 , vol. 44, # 24 p. 4563 - 4565
  • Route3
    • 1-Benzylindoline|CS-1152732
      6037-73-6
    • ~85%
    • In-stock
      1-Benzyl-1H-indole|CS-0206424
      3377-71-7

    References

    • Kamata, Keigo; Kasai, Jun; Yamaguchi, Kazuya; Mizuno, Noritaka Organic Letters, 2004 , vol. 6, # 20 p. 3577 - 3580

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   4.93
  • LogP   3.6896
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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