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CS-W001157 4
Total: USD 88.00

8-Methylisoquinolin-1(2H)-one

  • CAS No. 116409-35-9

  • Cat. No. CS-0569468
  • Purity≥98%
  • MDL No.None

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

8-Methylisoquinolin-1(2H)-one|CS-0569468

Structure of 116409-35-9

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General Information

  • CAS No. 116409-35-9
  • Cat. No. CS-0569468
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO
  • Molecular Weight 159.18
  • Synonym(s) 8-methylisoquinolin-1-ol
  • SMILES CC1=C2C(=CC=C1)C=CNC2=O

Synthesis

  • Route1

    References

    • Tsue, Hirohito; Fujinami, Hideyuki; Itakura, Takeshi; Tsuchiya, Ryuta; Kobayashi, Kimiko; Takahashi, Hiroki; Hirao, Ken-Ichi Journal of the Chemical Society - Perkin Transactions 1, 1999 , # 24 p. 3677 - 3683
  • Route2
    • null|null
      62882-00-2
    • ~%
    • 8-Methylisoquinolin-1(2H)-one|CS-0569468
      116409-35-9

    References

    • Hirao, Ken-Ichi; Tsuchiya, Ryuta; Yano, Yasuhiro; Tsue, Hirohito Heterocycles, 1996 , vol. 42, # 1 p. 415 - 422
  • Route3
    • null|null
      54879-71-9
    • ~%
    • 8-Methylisoquinolin-1(2H)-one|CS-0569468
      116409-35-9

    References

    • Hirao, Ken-Ichi; Tsuchiya, Ryuta; Yano, Yasuhiro; Tsue, Hirohito Heterocycles, 1996 , vol. 42, # 1 p. 415 - 422

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

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   1.83652
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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