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CS-W001157 4
Total: USD 88.00

7-(Benzyloxy)-4-chloro-6-methoxyquinoline-3-carbonitrile

  • CAS No. 214476-99-0

  • Cat. No. CS-B0693
  • Molecule weight324.76
  • Purity≥98%
  • MDL No.MFCD13181067

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

7-(Benzyloxy)-4-chloro-6-methoxyquinoline-3-carbonitrile|CS-B0693

Structure of 214476-99-0

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General Information

  • CAS No. 214476-99-0
  • Cat. No. CS-B0693
  • Purity ≥98%
  • MDL No. MFCD13181067
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₃ClN₂O₂
  • Molecular Weight 324.76
  • Synonym(s) None
  • SMILES N#CC1=C(Cl)C2=CC(OC)=C(OCC3=CC=CC=C3)C=C2N=C1

Synthesis

  • Route1
    • 7-(Benzyloxy)-4-hydroxy-6-methoxyquinoline-3-carbonitrile|CS-B0221
      214476-89-8
    • ~92%
    • 7-(Benzyloxy)-4-chloro-6-methoxyquinoline-3-carbonitrile|CS-B0693
      214476-99-0

    References

    • WYETH Patent: WO2008/109613 A1, 2008 ; Location in patent: Page/Page column 215 ;
  • Route2
    • null|null
      307353-92-0
    • ~10%
    • 7-(Benzyloxy)-4-chloro-6-methoxyquinoline-3-carbonitrile|CS-B0693
      214476-99-0

    References

    • AstraZeneca AB Patent: EP1584619 A1, 2005 ; Location in patent: Page/Page column 41-42 ; EP 1584619 A1
  • Route3

    References

    • American Cyanamid Company Patent: US6384051 B1, 2002 ;

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   4.34748
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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