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CS-W001157 4
Total: USD 88.00

4-Bromoindole-3-acetic Acid

  • CAS No. 89245-41-0

  • Cat. No. CS-0156994
  • Purity≥98%
  • MDL No.MFCD09751717

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

4-Bromoindole-3-acetic Acid|CS-0156994

Structure of 89245-41-0

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General Information

  • CAS No. 89245-41-0
  • Cat. No. CS-0156994
  • Purity ≥98%
  • MDL No. MFCD09751717
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈BrNO₂
  • Molecular Weight 254.08
  • Synonym(s) 4-Bromo-3-indoleacetic acid
  • SMILES C1=CC(=C2C(=CNC2=C1)CC(=O)O)Br

Description

4-Bromoindole-3-acetic acid integrates a brominated indole ring with a carboxylic acid side chain, enabling direct functionalization in synthetic biology and medicinal chemistry workflows. This bench-stable derivative offers enhanced reactivity for coupling reactions and serves as a key building block in the development of bioactive molecules.

Application

4-Bromoindole-3-acetic acid serves as a versatile building block in the synthesis of biologically active indole derivatives, particularly for constructing hormone analogs and heterocyclic scaffolds. Its bromine substituent enables palladium-catalyzed cross-coupling reactions, while the carboxylic acid group facilitates direct amidation or esterification. The molecule exhibits good bench stability and is compatible with standard purification methods, making it suitable for iterative synthetic workflows in medicinal chemistry and natural product synthesis.

Synthesis

  • Route1

    References

    • Chemical and Pharmaceutical Bulletin, , vol. 33, # 9 p. 3696 - 3708
  • Route2
    • null|null
      89434-01-5
    • ~92%
    • In-stock
      4-Bromoindole-3-acetic Acid|CS-0156994
      89245-41-0

    References

    • Chemical and Pharmaceutical Bulletin, , vol. 33, # 9 p. 3696 - 3708
  • Route3

    References

    • Chemical and Pharmaceutical Bulletin, , vol. 33, # 9 p. 3696 - 3708

Safety Information

Download SDS
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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   53.09
  • LogP   2.5575
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   2

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