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CS-W001157 4
Total: USD 88.00

Indole-2-carboxylic acid, 4-bromo-

  • CAS No. 16732-64-2

  • Cat. No. CS-0030481
  • Purity≥97%
  • MDL No.MFCD02664468

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

Indole-2-carboxylic acid, 4-bromo-|CS-0030481

Structure of 16732-64-2

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General Information

  • CAS No. 16732-64-2
  • Cat. No. CS-0030481
  • Purity ≥97%
  • MDL No. MFCD02664468
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆BrNO₂
  • Molecular Weight 240.05
  • Synonym(s) 4-Bromo-2-indolecarboxylic acid
  • SMILES O=C(C(N1)=CC2=C1C=CC=C2Br)O

Description

4-Bromo-1H-indole-2-carboxylic acid features a bromine substituent at the 4-position and a carboxylic acid group at C2, enabling direct functionalization in heterocyclic synthesis. This electron-deficient indole scaffold integrates readily into bioactive molecule frameworks, particularly in medicinal chemistry campaigns targeting kinase inhibitors and receptor modulators. The carboxylic acid facilitates derivatization via amide coupling or esterification under standard conditions.

Application

4-Bromo-1H-indole-2-carboxylic acid serves as a versatile building block for the synthesis of biologically active indole derivatives. The bromo group enables palladium-catalyzed cross-coupling reactions, while the carboxylic acid facilitates amide bond formation and derivatization. Its bench-stable nature and compatibility with standard protecting group strategies make it well-suited for medicinal chemistry campaigns and API intermediate development.

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

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Computational Chemistry Data

  • TPSA   53.09
  • LogP   2.6286
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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