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6-Methoxy-3-methyl-2H-isoquinolin-1-one

  • CAS No. 869897-98-3

  • Cat. No. CS-0341678
  • Molecule weight189.21
  • Purity≥96%
  • MDL No.None

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

6-Methoxy-3-methyl-2H-isoquinolin-1-one|CS-0341678

Structure of 869897-98-3

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General Information

  • CAS No. 869897-98-3
  • Cat. No. CS-0341678
  • Purity ≥96%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₂
  • Molecular Weight 189.21
  • Synonym(s) 6-Methoxy-3-methylisoquinolin-1(2H)-one
  • SMILES CC1=CC2=CC(=CC=C2C(=O)N1)OC

Synthesis

  • Route1
    • 4-acetyl-6-methoxyisochromane-1,3-dione|CS-0746345
      918662-40-5
    • ~73%
    • In-stock
      6-Methoxy-3-methyl-2H-isoquinolin-1-one|CS-0341678
      869897-98-3

    References

    • VIROBAY, INC. Patent: WO2007/5838 A2, 2007 ; Location in patent: Page/Page column 69-70 ;

Safety Information

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

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Computational Chemistry Data

  • TPSA   42.09
  • LogP   1.84512
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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