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CS-W001157 4
Total: USD 88.00

1-Methyl-2-(methylsulfonyl)-5-nitro-1H-imidazole

  • CAS No. 1615-53-8

  • Cat. No. CS-0151213
  • Purity≥96%
  • MDL No.MFCD26407320

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

1-Methyl-2-(methylsulfonyl)-5-nitro-1H-imidazole|CS-0151213

Structure of 1615-53-8

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General Information

  • CAS No. 1615-53-8
  • Cat. No. CS-0151213
  • Purity ≥96%
  • MDL No. MFCD26407320
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₇N₃O₄S
  • Molecular Weight 205.19
  • Synonym(s) None
  • SMILES CN1C(=CN=C1S(=O)(=O)C)[N+](=O)[O-]

Synthesis

  • Route1
    • 1-Methyl-2-(methylthio)-5-nitro-1H-imidazole|CS-0186353
      1615-41-4
    • ~87%
    • 1-Methyl-2-(methylsulfonyl)-5-nitro-1H-imidazole|CS-0151213
      1615-53-8

    References

    • Chauviere, Gerard; Bouteille, Bernard; Enanga, Bertin; De Albuquerque, Cristina; Croft, Simon L.; Dumas, Michel; Perie, Jacques Journal of Medicinal Chemistry, 2003 , vol. 46, # 3 p. 427 - 440
  • Route2

    References

    • Chauviere, Gerard; Bouteille, Bernard; Enanga, Bertin; De Albuquerque, Cristina; Croft, Simon L.; Dumas, Michel; Perie, Jacques Journal of Medicinal Chemistry, 2003 , vol. 46, # 3 p. 427 - 440

Safety Information

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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

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Computational Chemistry Data

  • TPSA   95.1
  • LogP   -0.2682
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   2

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