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CS-W001157 4
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1-(1,2,3,4-Tetrahydroisoquinolin-2-yl)ethan-1-one

  • CAS No. 14028-67-2

  • Cat. No. CS-0256396
  • Purity≥98%
  • MDL No.None

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

1-(1,2,3,4-Tetrahydroisoquinolin-2-yl)ethan-1-one|CS-0256396

Structure of 14028-67-2

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General Information

  • CAS No. 14028-67-2
  • Cat. No. CS-0256396
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO
  • Molecular Weight 175.23
  • Synonym(s) 2-Acetyl-1,2,3,4-tetrahydroisoquinoline
  • SMILES CC(=O)N1CCC2=CC=CC=C2C1

Synthesis

  • Route1

    References

    • Aubert, Catherine; Huard-Perrio, Cecile; Lasne, Marie-Claire Journal of the Chemical Society - Perkin Transactions 1, 1997 , # 19 p. 2837 - 2842
  • Route2

    References

    • Sugiura, Michiharu; Asai, Koosuke; Hatano, Keiichiro; Kurono, Yukihisa; Hamada, Yoshiki Heterocycles, 2000 , vol. 53, # 4 p. 821 - 830
  • Route3

    References

    • Holland, Herbert L.; Bergen, Eleanor J.; Chenchaiah, P. Chinna; Khan, Shaheer H.; Munoz, Benito; et al. Canadian Journal of Chemistry, 1987 , vol. 65, p. 502 - 507

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   20.31
  • LogP   1.5912
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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