(1R,2R,3S,5S,8R)-3-(Benzoyloxy)-2-(Methoxycarbonyl)-8-Methyl-8-Azoniabicyclo[3.2.1]Octane

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Properties Simple | Detailed

Formula C17H22NO4+
IUPAC Name methyl (1r,2r,3s,5s)-3-(benzoyloxy)-8-methyl-8-azoniabicyclo[3.2.1]octane-2-carboxylate
Molecular Mass 304.361 g·mol−1
Heat of Formation -454.6 ± 16.7 kJ·mol−1
Dipole Moment 20.55 ± 1.08 D
Volume 364.11 Å 3
Surface Area 299.13 Å 2
Point Group Symmetry C1
Synonyms
  • (1r,2r,3s,5s)-3-(benzoyloxy)-8-methyl-8-azoniabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
  • (1r,2r,3s,5s)-8-methyl-3-(oxo-phenylmethoxy)-8-azoniabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
  • methyl (1r,2r,3s,5s)-8-methyl-3-phenylcarbonyloxy-8-azoniabicyclo[3.2.1]octane-2-carboxylate
InChIKey ZPUCINDJVBIVPJ-LJISPDSOSA-O
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