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CS-W001157 4
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2-Chloro-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethan-1-one

  • CAS No. 113369-47-4

  • Cat. No. CS-0316657
  • Purity≥97%
  • MDL No.None

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

2-Chloro-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethan-1-one|CS-0316657

Structure of 113369-47-4

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General Information

  • CAS No. 113369-47-4
  • Cat. No. CS-0316657
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₄ClNO₂
  • Molecular Weight 251.71
  • Synonym(s) 2-chloro-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethanone
  • SMILES CC1=C(C2=C(C=CC(=C2)OC)N1C)C(=O)CCl

Synthesis

  • Route1
    • 5-Methoxy-1,2-Dimethyl-1H-indole|CS-0767596
      17591-06-9
    • null|null
      79-04-9
    • ~68%
    • 2-Chloro-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethan-1-one|CS-0316657
      113369-47-4

    References

    • Journal of Organic Chemistry USSR (English Translation), , vol. 23, # 6 p. 1171 - 1179 Zhurnal Organicheskoi Khimii, , vol. 23, # 6 p. 1294 - 1304

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   31.23
  • LogP   2.91682
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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