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CS-W001157 4
Total: USD 88.00

Ethyl 1-methyl-4-nitroimidazole-2-carboxylate

  • CAS No. 109012-23-9

  • Cat. No. CS-W001046
  • Purity≥97%
  • MDL No.MFCD03789110

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

Ethyl 1-methyl-4-nitroimidazole-2-carboxylate|CS-W001046

Structure of 109012-23-9

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General Information

  • CAS No. 109012-23-9
  • Cat. No. CS-W001046
  • Purity ≥97%
  • MDL No. MFCD03789110
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉N₃O₄
  • Molecular Weight 199.16
  • Synonym(s) 1H-Imidazole-2-carboxylicacid,1-methyl-4-nitro-,ethyl ester
  • SMILES CCOC(=O)c1nc(cn1C)[N+]([O-])=O

Synthesis

  • Route1

    References

    • UNIVERSITY OF WESTERN SYDNEY Patent: WO2005/33077 A1, 2005 ; Location in patent: Page/Page column 53-54 ;
  • Route2
    • In-stock
      Ethyl 5-nitro-1H-imidazole-2-carboxylate|CS-0005580
      865998-46-5
    • null|null
      74-88-4
    • ~97%
    • In-stock
      Ethyl 1-methyl-4-nitroimidazole-2-carboxylate|CS-W001046
      109012-23-9

    References

    • BAYER HEALTHCARE AG Patent: WO2006/89664 A2, 2006 ; Location in patent: Page/Page column 14; 29; 30 ;
  • Route3
    • In-stock
      2,2,2-Trichloro-1-(1-methyl-4-nitro-1H-imidazol-2-yl)ethan-1-one|CS-0108342
      120095-64-9
    • null|null
      141-52-6
    • ~96%
    • In-stock
      Ethyl 1-methyl-4-nitroimidazole-2-carboxylate|CS-W001046
      109012-23-9

    References

    • Wurtz, Nicholas R.; Turner, James M.; Baird, Eldon E.; Dervan, Peter B. Organic Letters, 2001 , vol. 3, # 8 p. 1201 - 1203

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   87.26
  • LogP   0.505
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   3

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