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CS-W001157 4
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1-Methyl-3-phenyl-1H-pyrrole-2,5-dione

  • CAS No. 54433-49-7

  • Cat. No. CS-0161790
  • Purity≥95%
  • MDL No.MFCD27925151

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

1-Methyl-3-phenyl-1H-pyrrole-2,5-dione|CS-0161790

Structure of 54433-49-7

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General Information

  • CAS No. 54433-49-7
  • Cat. No. CS-0161790
  • Purity ≥95%
  • MDL No. MFCD27925151
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉NO₂
  • Molecular Weight 187.19
  • Synonym(s) 1-methyl-3-phenylpyrrole-2,5-dione
  • SMILES O=C(C(C1=CC=CC=C1)=C2)N(C)C2=O

Synthesis

  • Route1
    • null|null
      1159989-28-2
    • ~%
    • 1-Methyl-3-phenyl-1H-pyrrole-2,5-dione|CS-0161790
      54433-49-7

    References

    • Manley-King, Clarina I.; Terre'Blanche, Gisella; Castagnoli Jr., Neal; Bergh, Jacobus J.; Petzer, Jacobus P. Bioorganic and Medicinal Chemistry, 2009 , vol. 17, # 8 p. 3104 - 3110
  • Route2

    References

    • Parke,Davis and Co. Patent: US2831867 , 1955 ;
  • Route3

    References

    • McKenzie, Thomas C.; Epstein, Joseph W.; Fanshawe, William J.; Dixon, J. Scott; Osterberg, Arnold C.; et al. Journal of Medicinal Chemistry, 1984 , vol. 27, # 5 p. 628 - 632

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331-H341
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P405-P501

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Computational Chemistry Data

  • TPSA   37.38
  • LogP   1.0686
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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