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CS-W001157 4
Total: USD 88.00

6-Bromo-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid

  • CAS No. 61588-11-2

  • Cat. No. CS-0067741
  • Molecule weight269.05
  • Purity95+%
  • MDL No.None

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

6-Bromo-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid|CS-0067741

Structure of 61588-11-2

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General Information

  • CAS No. 61588-11-2
  • Cat. No. CS-0067741
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅BrN₂O₃
  • Molecular Weight 269.05
  • Synonym(s) 6-broMo-4-oxo-1H-cinnoline-3-carboxylic acid
  • SMILES O=C1C(C(O)=O)=NNC2=CC=C(Br)C=C21

Synthesis

  • Route1
    • null|null
      90271-82-2
    • ~%
    • 6-Bromo-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid|CS-0067741
      61588-11-2

    References

    • Barber,H.J. et al. Journal of the Chemical Society, 1961 , p. 2828 - 2843 Full Text View citing articles Show Details May and Baker Ltd. Patent: DE1017617 , 1954 ;
  • Route2
    • null|null
      90484-39-2
    • ~%
    • 6-Bromo-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid|CS-0067741
      61588-11-2

    References

    • Barber,H.J. et al. Journal of the Chemical Society, 1961 , p. 2828 - 2843 Full Text View citing articles Show Details May and Baker Ltd. Patent: DE1017617 , 1954 ;
  • Route3
    • null|null
      20357-04-4
    • ~%
    • 6-Bromo-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid|CS-0067741
      61588-11-2

    References

    • Schofield; Swain Journal of the Chemical Society, 1949 , p. 2393,2396

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   83.05
  • LogP   1.3838
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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