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CS-W001157 4
Total: USD 88.00

4-chloro-5-methoxyquinoline-3-carbonitrile

  • CAS No. 331662-72-7

  • Cat. No. CS-0001105
  • Purity≥98%
  • MDL No.MFCD13181060

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

4-chloro-5-methoxyquinoline-3-carbonitrile|CS-0001105

Structure of 331662-72-7

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General Information

  • CAS No. 331662-72-7
  • Cat. No. CS-0001105
  • Purity ≥98%
  • MDL No. MFCD13181060
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇ClN₂O
  • Molecular Weight 218.64
  • Synonym(s) None
  • SMILES N#CC1=C(Cl)C(C(N=C1)=CC=C2)=C2OC

Synthesis

  • Route1

    References

    • Boschelli; Wang; Ye; Wu; Zhang; Dutia; Powell; Wissner; Arndt; Weber Journal of Medicinal Chemistry, 2001 , vol. 44, # 5 p. 822 - 833
  • Route2
    • 3-Quinolinecarbonitrile, 1,4-dihydro-5-methoxy-4-oxo-|CS-0001194
      331662-64-7
    • ~%
    • 4-chloro-5-methoxyquinoline-3-carbonitrile|CS-0001105
      331662-72-7

    References

    • Boschelli; Wang; Ye; Wu; Zhang; Dutia; Powell; Wissner; Arndt; Weber Journal of Medicinal Chemistry, 2001 , vol. 44, # 5 p. 822 - 833
  • Route3

    References

    • Zhang, Nan; Wu, Biqi; Powell, Dennis; Wissner, Allan; B. Floyd, Middleton; D. Kovacs, Eleonora; Toral-Barza, Lourdes; Kohler, Constance Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 24 p. 2825 - 2828

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

Quality Control

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Computational Chemistry Data

  • TPSA   45.91
  • LogP   2.76848
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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