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CS-W001157 4
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3-Quinolinecarbonitrile, 4-chloro-6-methoxy-7-(1-methylethoxy)-

  • CAS No. 741276-43-7

  • Cat. No. CS-0001078
  • Molecule weight276.72
  • Purity≥98%
  • MDL No.None

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

3-Quinolinecarbonitrile, 4-chloro-6-methoxy-7-(1-methylethoxy)-|CS-0001078

Structure of 741276-43-7

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General Information

  • CAS No. 741276-43-7
  • Cat. No. CS-0001078
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₃ClN₂O₂
  • Molecular Weight 276.72
  • Synonym(s) 4-Chloro-7-isopropoxy-6-methoxyquinoline-3-carbonitrile
  • SMILES N#CC1=C(Cl)C2=CC(OC)=C(OC(C)C)C=C2N=C1

Synthesis

  • Route1
    • 7-isopropoxy-6-methoxy-4-oxo-1,4-dihydroquinoline-3-carbonitrile|CS-0001195
      319492-96-1
    • ~78%
    • 3-Quinolinecarbonitrile, 4-chloro-6-methoxy-7-(1-methylethoxy)-|CS-0001078
      741276-43-7

    References

    • Cao, Xin; You, Qi-Dong; Li, Zhi-Yu; Guo, Qing-Long; Shang, Jing; Yan, Ming; Chern, Ji-Wang; Chen, Men-Ling Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 11 p. 5890 - 5898
  • Route2

    References

    • Wang, Yanong D.; Miller, Karen; Boschelli, Diane H.; Ye, Fei; Wu, Biqi; Floyd; Powell, Dennis W.; Wissner, Allan; Weber, Jennifer M.; Boschelli, Frank Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 21 p. 2477 - 2480
  • Route3
    • methyl 4-isopropoxy-3-methoxybenzoate|CS-0005788
      3535-27-1
    • ~%
    • 3-Quinolinecarbonitrile, 4-chloro-6-methoxy-7-(1-methylethoxy)-|CS-0001078
      741276-43-7

    References

    • Wang, Yanong D.; Miller, Karen; Boschelli, Diane H.; Ye, Fei; Wu, Biqi; Floyd; Powell, Dennis W.; Wissner, Allan; Weber, Jennifer M.; Boschelli, Frank Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 21 p. 2477 - 2480

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   55.14
  • LogP   3.55568
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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