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CS-W001157 4
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2-(5-Cyano-1H-indol-1-yl)aceticacid

  • CAS No. 202124-67-2

  • Cat. No. CS-0171493
  • Molecule weight200.19
  • Purity≥97%
  • MDL No.None

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

2-(5-Cyano-1H-indol-1-yl)aceticacid|CS-0171493

Structure of 202124-67-2

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General Information

  • CAS No. 202124-67-2
  • Cat. No. CS-0171493
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈N₂O₂
  • Molecular Weight 200.19
  • Synonym(s) 5-Cyanoindole-1-acetic acid
  • SMILES C1=CC2=C(C=CN2CC(=O)O)C=C1C#N

Synthesis

  • Route1

    References

    • Zou, Yiquan; Li, Li; Chen, Wuyan; Chen, Tiantian; Ma, Lanping; Wang, Xin; Xiong, Bing; Xu, Yechun; Shen, Jingkang Molecules, 2013 , vol. 18, # 5 p. 5706 - 5722
  • Route2
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      202124-65-0
    • ~%
    • 2-(5-Cyano-1H-indol-1-yl)aceticacid|CS-0171493
      202124-67-2

    References

    • Wu, Lingyun; Lu, Kai; Packiarajan, Mathivanan; Jubian, Vrej; Chandrasena, Gamini; Wolinsky, Toni C.; Walker, Mary W. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 6 p. 2167 - 2171

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   66.02
  • LogP   1.59758
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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