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CS-W001157 4
Total: USD 88.00

2-(7-Methyl-1h-indol-3-yl)acetic acid

  • CAS No. 5435-36-9

  • Cat. No. CS-0217768
  • Molecule weight189.21
  • Purity≥96%
  • MDL No.None

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

2-(7-Methyl-1h-indol-3-yl)acetic acid|CS-0217768

Structure of 5435-36-9

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General Information

  • CAS No. 5435-36-9
  • Cat. No. CS-0217768
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₂
  • Molecular Weight 189.21
  • Synonym(s) 7-METHYLINDOLE-3-ACETIC ACID(7MeIAA)
  • SMILES CC1=C2C(=CC=C1)C(=CN2)CC(=O)O

Description

2-(7-Methyl-1H-indol-3-yl)acetic acid features a benzene-fused indole core with a methyl group at the 7-position, enhancing electron density and metabolic stability. The pendant acetic acid moiety enables direct conjugation or derivatization under standard coupling conditions. This structure integrates seamlessly into bioactive molecule scaffolds, particularly in CNS-targeted pharmaceuticals and synthetic intermediates requiring lipophilic, aromatic character.

Application

2-(7-Methyl-1H-indol-3-yl)acetic acid serves as a versatile building block for indole-based bioactive molecules, enabling efficient access to pharmaceutically relevant scaffolds. Its carboxylic acid functionality facilitates direct amidation, esterification, and coupling reactions under standard conditions. The 7-methyl substitution enhances metabolic stability and modulates electronic properties, while the indole core provides inherent π-stacking and hydrogen-bonding capacity. Bench-stable and readily purified by recrystallization, it functions reliably in medicinal chemistry campaigns targeting CNS agents and kinase inhibitors.

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P501

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Computational Chemistry Data

  • TPSA   53.09
  • LogP   2.10342
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   2

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