Methyl (1R,2R,3S,5S)-8-Methyl-3-(4-Methylphenyl)-8-Azabicyclo[3.2.1]Octane-2-Carboxylate

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Formula C17H23NO2
IUPAC Name methyl (1r,2r,3s,5s)-8-methyl-3-(p-tolyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
Molecular Mass 273.370 g·mol−1
Heat of Formation -330.0 ± 16.7 kJ·mol−1
Dipole Moment 0.79 ± 1.08 D
Volume 351.06 Å 3
Surface Area 297.94 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r,3s,5s)-8-methyl-3-(4-methylphenyl)-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
InChIKey MMKZDDDDODERSJ-ZJIFWQFVSA-N
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