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Ethyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboxylate

  • CAS No. 256376-59-7

  • Cat. No. CS-0464955
  • Purity≥98%
  • MDL No.MFCD20268230

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

Ethyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboxylate|CS-0464955

Structure of 256376-59-7

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General Information

  • CAS No. 256376-59-7
  • Cat. No. CS-0464955
  • Purity ≥98%
  • MDL No. MFCD20268230
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₄FN₃O₂
  • Molecular Weight 299.30
  • Synonym(s) 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid ethyl ester
  • SMILES CCOC(=O)C1=NN(CC2=CC=CC=C2F)C3=C1C=CC=N3

Synthesis

  • Route1

    References

    • Bayer Healthcare AG Patent: US2007/225299 A1, 2007 ; Location in patent: Page/Page column 8-9 ;
  • Route2

    References

    • Bayer Aktiengesellschaft Patent: US6743798 B1, 2004 ; Location in patent: Page column 41-42 ;
  • Route3

    References

    • BAYER HEALTHCARE AG Patent: WO2004/9590 A1, 2004 ; Location in patent: Page/Page column 21 ;

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-H320-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   57.01
  • LogP   2.7954
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   4

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