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CS-W001157 4
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Methyl 4,5-dihydroxypyridine-2-carboxylate

  • CAS No. 527681-11-4

  • Cat. No. CS-0049064
  • Purity≥97%
  • MDL No.None

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

Methyl 4,5-dihydroxypyridine-2-carboxylate|CS-0049064

Structure of 527681-11-4

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General Information

  • CAS No. 527681-11-4
  • Cat. No. CS-0049064
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇NO₄
  • Molecular Weight 169.13
  • Synonym(s) Methyl 4,5-Dihydroxy-2-Pyridinecarboxylate
  • SMILES COC(=O)C1=NC=C(O)C(O)=C1

Synthesis

  • Route1
    • null|null
      67-56-1
    • 4,5-Dihydroxy-2-pyridinecarboxylic acid|CS-0162522
      43077-77-6
    • ~75%
    • Methyl 4,5-dihydroxypyridine-2-carboxylate|CS-0049064
      527681-11-4

    References

    • Walker, Daniel P.; Wishka, Donn G.; Piotrowski, David W.; Jia, Shaojuan; Reitz, Steven C.; Yates, Karen M.; Myers, Jason K.; Vetman, Tatiana N.; Margolis, Brandon J.; Jacobsen, E. Jon; Acker, Brad A.; Groppi, Vincent E.; Wolfe, Mark L.; Thornburgh, Bruce A.; Tinholt, Paula M.; Cortes-Burgos, Luz A.; Walters, Rodney R.; Hester, Matthew R.; Seest, Eric P.; Dolak, Lester A.; Han, Fusen; Olson, Barbara A.; Fitzgerald, Laura; Staton, Brian A.; Raub, Thomas J.; Hajos, Mihaly; Hoffmann, William E.; Li, Kai S.; Higdon, Nicole R.; Wall, Theron M.; Hurst, Raymond S.; Wong, Erik H.F.; Rogers, Bruce N. Bioorganic and Medicinal Chemistry, 2006 , vol. 14, # 24 p. 8219 - 8248

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   79.65
  • LogP   0.2794
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   1

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