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CS-W001157 4
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7-Methoxy-2,3,4,5-tetrahydro-1H-benzo[c]azepin-1-one

  • CAS No. 3648-86-0

  • Cat. No. CS-0135782
  • Purity≥97%
  • MDL No.MFCD00667644

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

7-Methoxy-2,3,4,5-tetrahydro-1H-benzo[c]azepin-1-one|CS-0135782

Structure of 3648-86-0

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General Information

  • CAS No. 3648-86-0
  • Cat. No. CS-0135782
  • Purity ≥97%
  • MDL No. MFCD00667644
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO₂
  • Molecular Weight 191.23
  • Synonym(s) 7-METHOXY-2,3,4,5-TETRAHYDRO-BENZO[C]AZEPIN-1-ONE
  • SMILES O=C1C2=CC=C(OC)C=C2CCCN1

Synthesis

  • Route1

    References

    • Ortega, Raquel; Huebner, Harald; Gmeiner, Peter; Masaguer, Christian F. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 9 p. 2670 - 2674
  • Route2

    References

    • NOVARTIS AG; NOVARTIS PHARMA GMBH Patent: WO2004/69256 A1, 2004 ; Location in patent: Page/Page column 31 ; WO 2004/069256 A1
  • Route3
    • 6-Methoxy-3,4-dihydronaphthalen-1(2H)-one oxime|CS-0594013
      54951-36-9
    • ~68%
    • In-stock
      7-Methoxy-2,3,4,5-tetrahydro-1H-benzo[c]azepin-1-one|CS-0135782
      3648-86-0
    • In-stock
      7-Methoxy-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one|CS-0004304
      22245-89-2

    References

    • Crosby, Ian T.; Shin, James K.; Capuano, Ben Australian Journal of Chemistry, 2010 , vol. 63, # 2 p. 211 - 226

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS09
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H411
Precautionary Statements : P273-P391-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.33
  • LogP   1.3712
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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