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Methyl 2-(1-methyl-1H-indol-3-yl)acetate

  • CAS No. 58665-00-2

  • Cat. No. CS-0151180
  • Purity≥95%
  • MDL No.MFCD14583100

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

Methyl 2-(1-methyl-1H-indol-3-yl)acetate|CS-0151180

Structure of 58665-00-2

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General Information

  • CAS No. 58665-00-2
  • Cat. No. CS-0151180
  • Purity ≥95%
  • MDL No. MFCD14583100
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO₂
  • Molecular Weight 203.24
  • Synonym(s) methyl 2-(N-methyl-1H-indol-3-yl)acetate
  • SMILES CN1C=C(CC(=O)OC)C2=CC=CC=C21

Synthesis

  • Route1

    References

    • DAIICHI PHARMACEUTICAL CO., LTD. Patent: EP1717238 A1, 2006 ; Location in patent: Page/Page column 50-51 ;
  • Route2

    References

    • Suarez-Castillo, Oscar R.; Melendez-Rodriguez, Myriam; Castelan-Duarte, Luis Enrique; Sanchez-Zavala, Maricruz; Rivera-Becerril, Ernesto; Morales-Rios, Martha S.; Joseph-Nathan, Pedro Tetrahedron Asymmetry, 2009 , vol. 20, # 20 p. 2374 - 2389
  • Route3

    References

    • Pour, Milan; Spulak, Marcel; Balsanek, Vojtech; Kunes, Jiri; Kubanova, Petra; Buchta, Vladimir Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 13 p. 2843 - 2866

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   31.23
  • LogP   1.8938
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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