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CS-W001157 4
Total: USD 88.00

2-(6-Chloro-1h-indol-1-yl)acetic acid

  • CAS No. 943654-33-9

  • Cat. No. CS-0251043
  • Molecule weight209.63
  • Purity≥98%
  • MDL No.None

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

2-(6-Chloro-1h-indol-1-yl)acetic acid|CS-0251043

Structure of 943654-33-9

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General Information

  • CAS No. 943654-33-9
  • Cat. No. CS-0251043
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈ClNO₂
  • Molecular Weight 209.63
  • Synonym(s) (6-Chloro-1H-indol-1-yl)acetic acid
  • SMILES C1=CC(=CC2=C1C=CN2CC(=O)O)Cl

Description

2-(6-Chloro-1H-indol-1-yl)acetic acid features a chlorinated indole core linked to a carboxylic acid side chain, enabling direct conjugation in bioactive molecule synthesis. The electron-deficient aromatic system enhances reactivity in coupling reactions, while the pendant acid group facilitates derivatization under standard conditions. This scaffold supports targeted drug discovery efforts involving indole-based pharmacophores.

Application

2-(6-Chloro-1H-indol-1-yl)acetic acid serves as a key building block for indole-based pharmaceutical intermediates, enabling efficient conjugation via amide and ester formation. Its bench-stable nature and compatibility with standard coupling reactions facilitate straightforward derivatization. The molecule functions as a versatile scaffold in the synthesis of bioactive heterocycles and supports orthogonal functional group manipulation in medicinal chemistry workflows.

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   42.23
  • LogP   2.3793
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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