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CS-W001157 4
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6-Methoxy-3,4-dihydronaphthalene-1-carbonitrile

  • CAS No. 6398-50-1

  • Cat. No. CS-0580505
  • Molecule weight185.22
  • Purity≥98%
  • MDL No.None

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

6-Methoxy-3,4-dihydronaphthalene-1-carbonitrile|CS-0580505

Structure of 6398-50-1

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General Information

  • CAS No. 6398-50-1
  • Cat. No. CS-0580505
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁NO
  • Molecular Weight 185.22
  • Synonym(s) 1-Cyano-6-methoxy-3,4-dihydronaphtalene
  • SMILES COC1=CC2=C(C=C1)C(=CCC2)C#N

Synthesis

  • Route1

    References

    • Abbott Laboratories Patent: US5248677 A1, 1993 ;
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 7 p. 1049 - 1062
  • Route3
    • null|null
      7677-24-9
    • 6-Methoxy-1,2,3,4-tetrahydronaphthalene|CS-0204248
      1730-48-9
    • ~52%
    • 6-Methoxy-3,4-dihydronaphthalene-1-carbonitrile|CS-0580505
      6398-50-1

    References

    • Lemaire, Marc; Doussot, Joel; Guy, Alain Chemistry Letters, 1988 , # 10 p. 1581 - 1584

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   2.54838
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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