(1R,2R,5S)-8-Methyl-8-Azabicyclo[3.2.1]Oct-2-Yl Hydroxy(Diphenyl)Acetate

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Formula C22H25NO3
IUPAC Name [(1s,4r,5r,8s)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl] 2-hydroxy-2,2-diphenyl-acetate
Molecular Mass 351.439 g·mol−1
Heat of Formation -361.0 ± 16.7 kJ·mol−1
Dipole Moment 3.93 ± 1.08 D
Volume 430.77 Å 3
Surface Area 349.88 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
Synonyms
  • (+)-2-alpha-tropan-2-ol, diphenylglycolate
  • 2-hydroxy-2,2-di(phenyl)acetic acid [(1r,2r,5s)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl] ester
  • [(1r,2r,5s)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl] 2-hydroxy-2,2-di(phenyl)acetate
  • [(1r,2r,5s)-8-methyl-8-azabicyclo[3.2.1]octan-2-yl] 2-hydroxy-2,2-di(phenyl)ethanoate
  • n-methyltropanyl benzilate
CAS Number(s)
  • 64471-12-1
InChIKey LSJGAYNIIMEDLR-XUVXKRRUSA-N
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