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CS-W001157 4
Total: USD 88.00

1-(6-Methoxy-1H-indol-3-yl)ethan-1-one

  • CAS No. 99532-52-2

  • Cat. No. CS-0312717
  • Purity95+%
  • MDL No.None

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

1-(6-Methoxy-1H-indol-3-yl)ethan-1-one|CS-0312717

Structure of 99532-52-2

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General Information

  • CAS No. 99532-52-2
  • Cat. No. CS-0312717
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₂
  • Molecular Weight 189.21
  • Synonym(s) 1-(6-methoxy-1H-indol-3-yl)ethanone
  • SMILES CC(=O)C1=CNC2=C1C=CC(=C2)OC

Synthesis

  • Route1

    References

    • De Luca, Laura; Barreca, Maria Letizia; Ferro, Stefania; Iraci, Nunzio; Michiels, Martine; Christ, Frauke; Debyser, Zeger; Witvrouw, Myriam; Chimirri, Alba Bioorganic and Medicinal Chemistry Letters, 2008 , vol. 18, # 9 p. 2891 - 2895
  • Route2
    • 1-(6-Methoxy-1-(phenylsulfonyl)-1h-indol-3-yl)ethan-1-one|CS-0680372
      99532-46-4
    • ~76%
    • 1-(6-Methoxy-1H-indol-3-yl)ethan-1-one|CS-0312717
      99532-52-2

    References

    • Ketcha, Daniel M.; Gribble, Gordon W. Journal of Organic Chemistry, 1985 , vol. 50, # 26 p. 5451 - 5457
  • Route3
    • null|null
      1082892-90-7
    • ~89%
    • 1-(6-Methoxy-1H-indol-3-yl)ethan-1-one|CS-0312717
      99532-52-2

    References

    • Venkatanarayana; Dubey, Pramod K. Letters in Organic Chemistry, 2011 , vol. 8, # 9 p. 656 - 662

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   42.09
  • LogP   2.3791
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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