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2-Chloro-1-(6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one

  • CAS No. 66040-35-5

  • Cat. No. CS-0220470
  • Purity≥98%
  • MDL No.None

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

2-Chloro-1-(6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one|CS-0220470

Structure of 66040-35-5

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General Information

  • CAS No. 66040-35-5
  • Cat. No. CS-0220470
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₂₀ClNO₃
  • Molecular Weight 345.82
  • Synonym(s) 2-Chloro-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-ethanone
  • SMILES O=C(N1C(C2=CC=CC=C2)C3=C(C=C(OC)C(OC)=C3)CC1)CCl

Synthesis

  • Route1
    • (E)-N-(3,4-Dimethoxyphenethyl)-1-phenylmethanimine Verapamil Impurity|CS-0165349
      10133-74-1
    • null|null
      79-04-9
    • ~%
    • 2-Chloro-1-(6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one|CS-0220470
      66040-35-5

    References

    • Schering Corporation Patent: US5124337 A1, 1992 ;
  • Route2

    References

    • Gitto, Rosaria; Caruso, Roberta; Pagano, Benedetta; De Luca, Laura; Citraro, Rita; Russo, Emilio; De Sarro, Giovambattista; Chimirri, Alba Journal of Medicinal Chemistry, 2006 , vol. 49, # 18 p. 5618 - 5622

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.77
  • LogP   3.4167
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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