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CS-W001157 4
Total: USD 88.00

7-methoxy-1,2,3,5-tetrahydro-3-benzazepin-4-one

  • CAS No. 37682-06-7

  • Cat. No. CS-0035476
  • Molecule weight191.23
  • Purity≥97%
  • MDL No.None

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

7-methoxy-1,2,3,5-tetrahydro-3-benzazepin-4-one|CS-0035476

Structure of 37682-06-7

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General Information

  • CAS No. 37682-06-7
  • Cat. No. CS-0035476
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO₂
  • Molecular Weight 191.23
  • Synonym(s) 8-Methoxy-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one
  • SMILES COC1=CC=C2CCNC(=O)CC2=C1

Synthesis

  • Route1
    • 8-Methoxy-1,3-dihydro-2H-benzo[d]azepin-2-one|CS-0138273
      85175-85-5
    • ~96%
    • 7-methoxy-1,2,3,5-tetrahydro-3-benzazepin-4-one|CS-0035476
      37682-06-7

    References

    • Wang, Min; Gao, Mingzhang; Steele, Brandon L.; Glick-Wilson, Barbara E.; Brown-Proctor, Clive; Shekhar, Anantha; Hutchins, Gary D.; Zheng, Qi-Huang Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 14 p. 4713 - 4718
  • Route2

    References

    • Skogvall, Staffan; Bjork, Henrik; Berglund, Per Magnus; Dalence Guzman, Maria Fanny; Sterner, Olov Patent: US2005/165004 A1, 2005 ; Location in patent: Page/Page column 6 ;
  • Route3

    References

    • Dalence-Guzman, Maria F.; Berglund, Magnus; Skogvall, Staffan; Sterner, Olov Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 5 p. 2499 - 2512

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   38.33
  • LogP   0.91
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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