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Home> Hot Product Listed A   > AE-0701
1179362-99-2 structure

AE-0701

Iupac Name:benzyl 4-(3-aminoazetidin-1-yl)piperidine-1-carboxylate;dihydrochloride
CAS No.:1179362-99-2
Molecular Weight:362.295
Molecular Formula:C27H27N7O3 (isomer)
Computational chemical data
  • Molecular Weight:362.295g/mol
  • Molecular Formula:C27H27N7O3
  • Compound Is Canonicalized:True
  • Exact Mass:361.132
  • Monoisotopic Mass:361.132
  • Complexity:343
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:58.8A^2
  • Heavy Atom Count:23
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:3
  • CACTVS Substructure Key Fingerprint: AAADceB7MAAGAAAAAAAAAAAAAABYAAAAAAA8QAAAAAAAAAABAAAAHgAQAAAADCjhmAYwCINABACI AiBCGAACAAAgAAAIiIAICIgIZiKA8RicMAAk1gGIqAeQwCAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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