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CS-W001157 4
Total: USD 88.00

6-Bromo-2-chloroquinoline-3-carbonitrile

  • CAS No. 99465-04-0

  • Cat. No. CS-0467468
  • Purity≥98%
  • MDL No.MFCD09787668

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

6-Bromo-2-chloroquinoline-3-carbonitrile|CS-0467468

Structure of 99465-04-0

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General Information

  • CAS No. 99465-04-0
  • Cat. No. CS-0467468
  • Purity ≥98%
  • MDL No. MFCD09787668
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₄BrClN₂
  • Molecular Weight 267.51
  • Synonym(s) None
  • SMILES C1=CC2=NC(=C(C=C2C=C1Br)C#N)Cl

Synthesis

  • Route1
    • 6-Bromo-2-hydroxyquinoline-3-carbonitrile|CS-0462804
      99465-03-9
    • ~52%
    • 6-Bromo-2-chloroquinoline-3-carbonitrile|CS-0467468
      99465-04-0

    References

    • Alabaster; Bell; Campbell; Ellis; Henderson; Roberts; Ruddock; Samuels; Stefaniak Journal of Medicinal Chemistry, 1988 , vol. 31, # 10 p. 2048 - 2056
  • Route2
    • 2-Oxo-1,2-dihydroquinoline-3-carbonitrile|CS-0216519
      36926-82-6
    • ~%
    • 6-Bromo-2-chloroquinoline-3-carbonitrile|CS-0467468
      99465-04-0

    References

    • Journal of Medicinal Chemistry, , vol. 31, # 10 p. 2048 - 2056
  • Route3

    References

    • Tetrahedron, , vol. 67, # 47 p. 9219 - 9224

Safety Information

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

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Computational Chemistry Data

  • TPSA   36.68
  • LogP   3.52238
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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