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CS-W001157 4
Total: USD 88.00

5-Methoxy-3-methyl-1H-indole-2-carboxylic acid

  • CAS No. 16381-50-3

  • Cat. No. CS-0447864
  • Purity≥98%
  • MDL No.None

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

5-Methoxy-3-methyl-1H-indole-2-carboxylic acid|CS-0447864

Structure of 16381-50-3

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General Information

  • CAS No. 16381-50-3
  • Cat. No. CS-0447864
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₃
  • Molecular Weight 205.21
  • Synonym(s) 5-Methoxy-3-Methylindole-2-carboxylic Acid
  • SMILES CC1=C(C(=O)O)NC2=C1C=C(C=C2)OC

Synthesis

  • Route1
    • Ethyl 5-methoxy-3-methyl-1H-indole-2-carboxylate|CS-0316445
      16381-42-3
    • ~99%
    • 5-Methoxy-3-methyl-1H-indole-2-carboxylic acid|CS-0447864
      16381-50-3

    References

    • Zhao, Shuo; Liao, Xuebin; Wang, Tao; Flippen-Anderson, Judith; Cook, James M. Journal of Organic Chemistry, 2003 , vol. 68, # 16 p. 6279 - 6295
  • Route2
    • null|null
      104-94-9
    • ~%
    • 5-Methoxy-3-methyl-1H-indole-2-carboxylic acid|CS-0447864
      16381-50-3

    References

    • Journal of Organic Chemistry, , vol. 68, # 16 p. 6279 - 6295
  • Route3

    References

    • European Journal of Medicinal Chemistry, , vol. 68, p. 372 - 384

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

Quality Control

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Computational Chemistry Data

  • TPSA   62.32
  • LogP   2.18312
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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