Cocaine

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Properties Simple | Detailed

Formula C17H21NO4
IUPAC Name methyl (1s,3s,4r,5r,8s)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
Molecular Mass 303.353 g·mol−1
Heat of Formation -613.7 ± 16.7 kJ·mol−1
Dipole Moment 2.66 ± 1.08 D
Volume 365.71 Å 3
Surface Area 312.97 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-cocaine
  • (1r,2r,3s,5s)-2-(methoxycarbonyl)tropan-3-yl benzoate
  • (1r,2r,3s,5s)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
  • (1r,2r,3s,5s)-8-methyl-3-(oxo-phenylmethoxy)-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
  • (r)-cocaine
  • 1-alpha-h,5-alpha-h-tropane-2-beta-carboxylic acid, 3-beta-hydroxy-, methyl ester, benzoate (ester) (8ci)
  • 2-methyl-3beta-hydroxy-1alphah,5alphah-tropane-2beta-carboxylate benzoate (ester)
  • 3beta-hydroxy-2beta-tropanecarboxylic acid methyl ester benzoate (ester)
  • 8-azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, (1r,2r,3s,5s)- (9ci)
  • [1r-(exo,exo)]-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid, methyl ester
  • badrock
  • bazooka
  • blast
  • blizzard
  • bouncing powder
  • cabello
  • candy
  • caviar
  • charlie
  • chicken scratch
  • coc
  • coca
  • cocain
  • cocaine free base
  • cocaine solution
  • cocainum
  • cocktail
  • cola
  • ecgonine methyl ester benzoate
  • ecgonine methyl ester benzoate solution
  • flex
  • florida snow
  • foo foo
  • freeze
  • g-rock
  • goofball
  • happy powder
  • heaven
  • hell
  • kibbles n' bits
  • line
  • methyl (1r,2r,3s,5s)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
  • methyl (1r,2r,3s,5s)-8-methyl-3-phenylcarbonyloxy-8-azabicyclo[3.2.1]octane-2-carboxylate
  • methyl [1r-(exo,exo)]-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
  • moonrocks
  • prime time
  • sleighride
  • snort
  • snow (birds)
  • sweet stuff
  • toke
  • trails
  • yeyo
InChIKey ZPUCINDJVBIVPJ-LJISPDSOSA-N
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