Cas no 83817-42-9 ((7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate)

(7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate structure
83817-42-9 structure
Product Name:(7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate
CAS No:83817-42-9
MF:C15H25ClN2O6
MW:364.821803808212
CID:733143
PubChem ID:44151681
Update Time:2025-04-19

(7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate Chemical and Physical Properties

Names and Identifiers

    • (7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate
    • [7R-(7alpha,7abeta,9beta,14alpha,14alpha)]-dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-4-one monoperchlorate
    • (7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocin-4-one monoperchlorate
    • 83817-42-9
    • EINECS 280-943-4
    • Inchi: 1S/C15H24N2O2.ClHO4/c18-12-4-5-16-8-10-6-11(14(16)7-12)9-17-13(10)2-1-3-15(17)19;2-1(3,4)5/h10-14,18H,1-9H2;2H/t10-,11-,12-,13-,14-;/m1./s1
    • InChI Key: AORVUXJQKLVFSJ-XAWYEFCRSA-N
    • SMILES: [Cl+3]([O-])([O-])([O-])O.O[C@@H]1CCN2C[C@@H]3[C@H]4CCCC(N4C[C@@H](C3)[C@H]2C1)=O

Computed Properties

  • Exact Mass: 364.1401142g/mol
  • Monoisotopic Mass: 364.1401142g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 0
  • Complexity: 500
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 115?2

(7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate Related Literature

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