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CS-W001157 4
Total: USD 88.00

4-Methyl-3,4-dihydro-2H-isoquinolin-1-one

  • CAS No. 70079-42-4

  • Cat. No. CS-0341141
  • Purity≥96%
  • MDL No.None

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

4-Methyl-3,4-dihydro-2H-isoquinolin-1-one|CS-0341141

Structure of 70079-42-4

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General Information

  • CAS No. 70079-42-4
  • Cat. No. CS-0341141
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO
  • Molecular Weight 161.20
  • Synonym(s) 4-Methyl-3,4-dihydroisoquinolin-1(2H)-one
  • SMILES CC1CNC(C2=CC=CC=C12)=O

Synthesis

  • Route1
    • null|null
      111635-03-1
    • ~85%
    • 4-Methyl-3,4-dihydro-2H-isoquinolin-1-one|CS-0341141
      70079-42-4

    References

    • Kurouchi, Hiroaki; Kawamoto, Kyoko; Sugimoto, Hiromichi; Nakamura, Satoshi; Otani, Yuko; Ohwada, Tomohiko Journal of Organic Chemistry, 2012 , vol. 77, # 20 p. 9313 - 9328,16
  • Route2
    • null|null
      1392825-21-6
    • ~84%
    • 4-Methyl-3,4-dihydro-2H-isoquinolin-1-one|CS-0341141
      70079-42-4

    References

    • Raja, Erum K.; Nilsson Lill, Sten O.; Klumpp, Douglas A. Chemical Communications, 2012 , vol. 48, # 65 p. 8141 - 8143
  • Route3
    • 2-Phenylpropylamine|CS-0276147
      582-22-9
    • ~%
    • 4-Methyl-3,4-dihydro-2H-isoquinolin-1-one|CS-0341141
      70079-42-4

    References

    • Canfield, Lesley M.; Crabb, Trevor A. Journal of Chemical Research, Miniprint, 1997 , # 11 p. 2401 - 2416

Safety Information

Download SDS
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   29.1
  • LogP   1.5335
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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