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CS-W001157 4
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2-(7-Methoxy-3,4-dihydronaphthalen-1-yl)acetonitrile

  • CAS No. 861960-34-1

  • Cat. No. CS-0317069
  • Molecule weight199.25
  • Purity≥97%
  • MDL No.None

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

2-(7-Methoxy-3,4-dihydronaphthalen-1-yl)acetonitrile|CS-0317069

Structure of 861960-34-1

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General Information

  • CAS No. 861960-34-1
  • Cat. No. CS-0317069
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃NO
  • Molecular Weight 199.25
  • Synonym(s) Agomelatine intermediates
  • SMILES COC1=CC2=C(CCC=C2CC#N)C=C1

Synthesis

  • Route1
    • 7-Methoxy-1-tetralone Agomelatine Impurity|CS-0214044
      6836-19-7
    • null|null
      372-09-8
    • ~91%
    • 2-(7-Methoxy-3,4-dihydronaphthalen-1-yl)acetonitrile|CS-0317069
      861960-34-1

    References

    • Souvie, Jean-Claude; Gonzalez Blanco, Isaac; Thominot, Gilles; Chapuis, Genevieve; Horvath, Stephane; Damien, Gerard Patent: US2005/182276 A1, 2005 ; Location in patent: Page/Page column 6 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   2.93848
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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