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CS-W001157 4
Total: USD 88.00

1-(2-(4-Nitrophenyl)-2-oxoethyl)pyridin-1-ium iodide

  • CAS No. 5330-73-4

  • Cat. No. CS-0549789
  • Molecule weight370.14
  • Purity≥98%
  • MDL No.None

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

1-(2-(4-Nitrophenyl)-2-oxoethyl)pyridin-1-ium iodide|CS-0549789

Structure of 5330-73-4

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General Information

  • CAS No. 5330-73-4
  • Cat. No. CS-0549789
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₁IN₂O₃
  • Molecular Weight 370.14
  • Synonym(s) 1-[2-(4-Nitrophenyl)-2-oxoethyl]pyridin-1-ium iodide
  • SMILES C1=CC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-].[I-]

Synthesis

  • Route1
    • null|null
      110-86-1
    • p-Nitrophenyl methyl ketone Clenbuterol  Impurity|CS-0229063
      100-19-6
    • ~71%
    • 1-(2-(4-Nitrophenyl)-2-oxoethyl)pyridin-1-ium iodide|CS-0549789
      5330-73-4

    References

    • Sasaki, Isabelle; Vendier, Laure; Sournia-Saquet, Alix; Lacroix, Pascal G. European Journal of Inorganic Chemistry, 2006 , # 16 p. 3294 - 3302

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

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Computational Chemistry Data

  • TPSA   64.09
  • LogP   -1.2308
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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