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CS-W001157 4
Total: USD 88.00

6,7-dimethoxy-1H-quinolin-4-one

  • CAS No. 127285-54-5

  • Cat. No. CS-0039799
  • Molecule weight205.21
  • Purity≥97%
  • MDL No.None

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

6,7-dimethoxy-1H-quinolin-4-one|CS-0039799

Structure of 127285-54-5

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General Information

  • CAS No. 127285-54-5
  • Cat. No. CS-0039799
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₃
  • Molecular Weight 205.21
  • Synonym(s) 4(3H)-quinolinone, 6,7-dimethoxy-
  • SMILES O=C1C=CNC2=C1C=C(OC)C(OC)=C2.[(Z)]

Synthesis

  • Route1

    References

    • Kirin Beer Kabushiki Kaisha Patent: US6187926 B1, 2001 ;
  • Route2
    • 5-[[(3,4-Dimethoxyphenyl)amino]methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione|CS-0007005
      213699-53-7
    • ~75%
    • 6,7-dimethoxy-1H-quinolin-4-one|CS-0039799
      127285-54-5

    References

    • Raeppel, Stephane; Claridge, Stephen William; Saavedra, Oscar Mario; Vaisburg, Arkadii; Deziel, Robert; Zhan, Lijie; Mannion, Michael; Gaudette, Frederic; Zhou, Nancy Z.; Isakovic, Ljubomir Patent: US2008/4273 A1, 2008 ; Location in patent: Page/Page column 61 ; US 20080004273 A1
  • Route3
    • Ethyl 4-hydroxy-6,7-dimethoxyquinoline-3-carboxylate|CS-0337726
      13436-14-1
    • ~%
    • 6,7-dimethoxy-1H-quinolin-4-one|CS-0039799
      127285-54-5

    References

    • Bioorganic and Medicinal Chemistry, , vol. 11, # 23 p. 5117 - 5133 Journal of Medicinal Chemistry, , vol. 49, # 7 p. 2186 - 2192

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-H319
Precautionary Statements : P264-P270-P280-P305+P351+P338-P330-P501

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Computational Chemistry Data

  • TPSA   51.32
  • LogP   2.1814
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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