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CS-W001157 4
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Methyl 1-methyl-9H-pyrido[3,4-b]indole-3-carboxylate

  • CAS No. 16641-82-0

  • Cat. No. CS-0062565
  • Molecule weightNone
  • Purity≥95%
  • MDL No.MFCD00436516

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

Methyl 1-methyl-9H-pyrido[3,4-b]indole-3-carboxylate|CS-0062565

Structure of 16641-82-0

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General Information

  • CAS No. 16641-82-0
  • Cat. No. CS-0062565
  • Purity ≥95%
  • MDL No. MFCD00436516
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₂N₂O₂
  • Molecular Weight None
  • Synonym(s) 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-methyl-, methyl ester
  • SMILES COC(C(N=C1C)=CC2=C1NC3=C2C=CC=C3)=O

Synthesis

  • Route1
    • (1S,3S)-Methyl 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate|CS-0214395
      93598-06-2
    • ~66%
    • In-stock
      Methyl 1-methyl-9H-pyrido[3,4-b]indole-3-carboxylate|CS-0062565
      16641-82-0

    References

    • Li, Chunyu; Zhang, Xiaoyi; Zhao, Ming; Wang, Yuji; Wu, Jianhui; Liu, Jiawang; Zheng, Meiqing; Peng, Shiqi European Journal of Medicinal Chemistry, 2011 , vol. 46, # 11 p. 5598 - 5608
  • Route2
    • Methyl 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate|CS-0570227
      16108-10-4
    • ~91%
    • In-stock
      Methyl 1-methyl-9H-pyrido[3,4-b]indole-3-carboxylate|CS-0062565
      16641-82-0

    References

    • Razmilic; Castillo; Lopez Journal of Heterocyclic Chemistry, 1980 , vol. 17, # 3 p. 595 - 596
  • Route3
    • null|null
      93712-59-5
    • ~80%
    • In-stock
      Methyl 1-methyl-9H-pyrido[3,4-b]indole-3-carboxylate|CS-0062565
      16641-82-0

    References

    • Brahmbhatt, Keyur G.; Ahmed, Nafees; Sabde, Sudeep; Mitra, Debashis; Singh, Inder Pal; Bhutani, Kamlesh K. Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 15 p. 4416 - 4419

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   54.98
  • LogP   2.81112
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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