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CS-W001157 4
Total: USD 88.00

8-Azabicyclo[3.2.1]octan-3-one

  • CAS No. 5632-84-8

  • Cat. No. CS-0183311
  • Molecule weight125.17
  • Purity≥98%
  • MDL No.None

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

8-Azabicyclo[3.2.1]octan-3-one|CS-0183311

Structure of 5632-84-8

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General Information

  • CAS No. 5632-84-8
  • Cat. No. CS-0183311
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₁NO
  • Molecular Weight 125.17
  • Synonym(s) 4'-cyanobiphenyl-4-yl 4-butylcyclohexanecarboxylate
  • SMILES C1C[C@@H]2CC(=O)C[C@H]1N2

Synthesis

  • Route1

    References

    • Berdini, Valerio; Cesta, Maria C; Curti, Roberto; D'Anniballe, Gaetano; Bello, Nicoletta Di; Nano, Giuseppe; Nicolini, Luca; Topai, Alessandra; Allegretti, Marcello Tetrahedron, 2002 , vol. 58, # 28 p. 5669 - 5674
  • Route2
    • Ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate|CS-W010567
      32499-64-2
    • ~84%
    • 8-Azabicyclo[3.2.1]octan-3-one|CS-0183311
      5632-84-8

    References

    • Cheng, Jie; Xu, Liang; Stevens, Edwin D.; Trudell, Mark L.; Izenwasser, Sari; Wade, Dean Journal of Heterocyclic Chemistry, 2004 , vol. 41, # 4 p. 569 - 574
  • Route3

    References

    • WO2004/99178 A1, ; Page 54-55 ; WO 2004/099178 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   0.4699
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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