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CS-W001157 4
Total: USD 88.00

2-Methylindoline

  • CAS No. 6872-06-6

  • Cat. No. CS-W013390
  • Purity≥98%
  • MDL No.None

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

2-Methylindoline|CS-W013390

Structure of 6872-06-6

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General Information

  • CAS No. 6872-06-6
  • Cat. No. CS-W013390
  • Purity ≥98%
  • MDL No. None
  • Storage -20°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁N
  • Molecular Weight 133.19
  • Synonym(s) 2-Methyl-2,3-dihydro-1H-indole
  • SMILES CC1NC2=C(C=CC=C2)C1

Description

It is used as an active pharmaceutical intermediate.

Application

2-Methylindoline serves as a versatile heterocyclic building block in medicinal chemistry, offering a stable, bench-ready scaffold for C–H functionalization and transition-metal-catalyzed coupling reactions. Its electron-rich indoline core facilitates regioselective derivatization at the 3- and 4-positions, while the N-methyl group enhances metabolic stability and modulates solubility. This compound functions effectively in standard synthetic workflows, enabling efficient access to biologically relevant scaffolds with high reproducibility and ease of purification.

Synthesis

  • Route1

    References

    • Kotsuki, Hiyoshizo; Ushio, Yasuyuki; Ochi, Masamitsu Heterocycles, 1987 , vol. 26, # 7 p. 1771 - 1774
  • Route2

    References

    • Rogovik, V. M.; Chumak, V. T.; Dzvinka, R. I.; Shein, S. M. J. Appl. Chem. USSR (Engl. Transl.), 1981 , vol. 54, # 6 p. 1356 - 1359,1137 - 1140
  • Route3
    • In-stock
      1-Methylisatin|CS-0045288
      2058-74-4
    • null|null
      51315-70-9
    • ~79%
    • In-stock
      2-Methylindoline|CS-W013390
      6872-06-6

    References

    • Sword, Ryan; O'Sullivan, Steven; Murphy, John A. Australian Journal of Chemistry, 2013 , vol. 66, # 3 p. 314 - 322

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS09
Signal Word : Danger
UN#: 2810
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H311-H319-H400
Precautionary Statements : P264-P270-P273-P280-P302+P352-P330-P361+P364-P391-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   12.03
  • LogP   2.0431
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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