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CS-W001157 4
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2-Amino-5-bromo-1H-pyrrole-3,4-dicarbonitrile

  • CAS No. 98130-58-6

  • Cat. No. CS-0435930
  • Molecule weight211.02
  • Purity98+%
  • MDL No.None

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

2-Amino-5-bromo-1H-pyrrole-3,4-dicarbonitrile|CS-0435930

Structure of 98130-58-6

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General Information

  • CAS No. 98130-58-6
  • Cat. No. CS-0435930
  • Purity 98+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃BrN₄
  • Molecular Weight 211.02
  • Synonym(s) 2-Amino-5-bromo-3,4-di-cyanopyrole
  • SMILES N#CC1=C(N)NC(Br)=C1C#N

Synthesis

  • Route1
    • null|null
      670-54-2
    • ~81%
    • 2-Amino-5-bromo-1H-pyrrole-3,4-dicarbonitrile|CS-0435930
      98130-58-6

    References

    • Wilding, Birgit; Winkler, Margit; Petschacher, Barbara; Kratzer, Regina; Glieder, Anton; Klempier, Norbert Advanced Synthesis and Catalysis, 2012 , vol. 354, # 11-12 p. 2191 - 2198
  • Route2
    • null|null
      10035-10-6
    • null|null
      670-54-2
    • null|null
      67-64-1
    • ~%
    • 2-Amino-5-bromo-1H-pyrrole-3,4-dicarbonitrile|CS-0435930
      98130-58-6

    References

    • Middleton et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 2822,2826
  • Route3
    • null|null
      14778-29-1
    • null|null
      10035-10-6
    • null|null
      67-64-1
    • ~%
    • 2-Amino-5-bromo-1H-pyrrole-3,4-dicarbonitrile|CS-0435930
      98130-58-6

    References

    • Middleton et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 2822,2826

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-H332-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   89.39
  • LogP   1.10276
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   0

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