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CS-W001157 4
Total: USD 88.00

Methyl 3-cyanoindole-6-carboxylate

  • CAS No. 1000576-51-1

  • Cat. No. CS-0205680
  • Purity≥97%
  • MDL No.MFCD09878564

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

Methyl 3-cyanoindole-6-carboxylate|CS-0205680

Structure of 1000576-51-1

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General Information

  • CAS No. 1000576-51-1
  • Cat. No. CS-0205680
  • Purity ≥97%
  • MDL No. MFCD09878564
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈N₂O₂
  • Molecular Weight 200.19
  • Synonym(s) methyl 3-cyano-1H-indole-6-carboxylate
  • SMILES COC(=O)C1=CC2=C(C=C1)C(=CN2)C#N

Synthesis

  • Route1
    • In-stock
      Methyl 1H-indole-6-carboxylate|CS-W017455
      50820-65-0
    • null|null
      140-29-4
    • ~82%
    • In-stock
      Methyl 3-cyanoindole-6-carboxylate|CS-0205680
      1000576-51-1

    References

    • Zhang, Lianpeng; Wen, Qiaodong; Jin, Jisong; Wang, Chen; Lu, Ping; Wang, Yanguang Tetrahedron, 2013 , vol. 69, # 21 p. 4236 - 4240
  • Route2
    • null|null
      1189-71-5
    • In-stock
      Methyl 1H-indole-6-carboxylate|CS-W017455
      50820-65-0
    • ~%
    • In-stock
      Methyl 3-cyanoindole-6-carboxylate|CS-0205680
      1000576-51-1

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 13 p. 3942 - 3946

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   65.88
  • LogP   1.82618
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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