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CS-W001157 4
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6-Chloro-4-nitro-3-(trifluoromethyl)-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrrolo[2,3-b]pyridine

  • CAS No. 892414-51-6

  • Cat. No. CS-M2170
  • Purity≥97%
  • MDL No.MFCD26960978

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

6-Chloro-4-nitro-3-(trifluoromethyl)-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrrolo[2,3-b]pyridine|CS-M2170

Structure of 892414-51-6

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General Information

  • CAS No. 892414-51-6
  • Cat. No. CS-M2170
  • Purity ≥97%
  • MDL No. MFCD26960978
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₇ClF₃N₃O₃Si
  • Molecular Weight 395.84
  • Synonym(s) 1H-Pyrrolo[2,3-b]pyridine, 6-chloro-4-nitro-3-(trifluoroMethyl)-1-[[2-(triMethylsilyl)ethoxy]Methyl]-8
  • SMILES ClC1=NC2=C(C(C(F)(F)F)=CN2COCC[Si](C)(C)C)C([N+]([O-])=O)=C1

Synthesis

  • Route1
    • 6-Chloro-4-nitro-3-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine|CS-B0960
      892414-50-5
    • null|null
      76513-69-4
    • ~64%
    • 6-Chloro-4-nitro-3-(trifluoromethyl)-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrrolo[2,3-b]pyridine|CS-M2170
      892414-51-6

    References

    • Schirok, Hartmut; Paulsen, Holger; Kroh, Walter; Chen, Gang; Gao, Ping Organic Process Research and Development, 2010 , vol. 14, # 1 p. 168 - 173
  • Route2
    • 2,2,2-Trifluoro-1-(2-fluoropyridin-3-yl)ethane-1,1-diol|CS-1200706
      932406-33-2
    • ~%
    • 6-Chloro-4-nitro-3-(trifluoromethyl)-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrrolo[2,3-b]pyridine|CS-M2170
      892414-51-6

    References

    • Schirok, Hartmut; Figueroa-Perez, Santiago; Thutewohl, Michael; Paulsen, Holger; Kroh, Walter; Klewer, Dagmar Synthesis, 2007 , # 2 p. 251 - 258
  • Route3

    References

    • Schirok, Hartmut; Figueroa-Perez, Santiago; Thutewohl, Michael; Paulsen, Holger; Kroh, Walter; Klewer, Dagmar Synthesis, 2007 , # 2 p. 251 - 258

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   70.19
  • LogP   4.929
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   6

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