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CS-W001157 4
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Methyl 7-methoxy-2-methyl-1H-indole-3-carboxylate

  • CAS No. 354573-92-5

  • Cat. No. CS-0477756
  • Molecule weight219.24
  • Purity≥98%
  • MDL No.None

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

Methyl 7-methoxy-2-methyl-1H-indole-3-carboxylate|CS-0477756

Structure of 354573-92-5

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General Information

  • CAS No. 354573-92-5
  • Cat. No. CS-0477756
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO₃
  • Molecular Weight 219.24
  • Synonym(s) 1H-Indole-3-carboxylic acid,7-methoxy-2-methyl-,methyl ester
  • SMILES COC(=O)C1C2C(NC=1C)=C(OC)C=CC=2

Synthesis

  • Route1
    • null|null
      1082469-81-5
    • ~65%
    • Methyl 7-methoxy-2-methyl-1H-indole-3-carboxylate|CS-0477756
      354573-92-5

    References

    • Wuertz, Sebastian; Rakshit, Souvik; Neumann, Julia J.; Droege, Thomas; Glorius, Frank Angewandte Chemie - International Edition, 2008 , vol. 47, # 38 p. 7230 - 7233
  • Route2
    • null|null
      123958-75-8
    • ~64%
    • Methyl 7-methoxy-2-methyl-1H-indole-3-carboxylate|CS-0477756
      354573-92-5

    References

    • Neumann, Julia J.; Rakshit, Souvik; Droege, Thomas; Wuertz, Sebastian; Glorius, Frank Chemistry - A European Journal, 2011 , vol. 17, # 26 p. 7298 - 7303
  • Route3
    • 7-Methoxy-2-methyl-1H-indole|CS-0367471
      53512-46-2
    • ~%
    • Methyl 7-methoxy-2-methyl-1H-indole-3-carboxylate|CS-0477756
      354573-92-5

    References

    • Hynes Jr., John; Leftheris, Katerina; Wu, Hong; Pandit, Chennagiri; Chen, Ping; Norris, Derek J.; Chen, Bang-Chi; Zhao, Rulin; Kiener, Peter A.; Chen, Xiaorong; Turk, Lori A.; Patil-Koota, Vina; Gillooly, Kathleen M.; Shuster, David J.; McIntyre, Kim W. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 17 p. 2399 - 2402

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   51.32
  • LogP   2.27152
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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