(+)-Cocaine Hydrochloride

• Synonyms:

  8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, hydrochloride, [1S-(exo,exo)]

• Hazard Statement:

  Toxic if swallowed; UN number: UN1544; Packing Group: III

• Smiles:

  COC([C@H]1[C@@]2([H])N([C@@](CC2)([H])C[C@H]1OC(C3=CC=CC=C3)=O)C)=O.Cl

• Molecular Formula:

  C17H22ClNO4

• Molecular Weight:

  339.81

• InChI:

  InChI=1S/C17H21NO4.ClH/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11;/h3-7,12-15H,8-10H2,1-2H3;1H/t12-,13+,14-,15+;/m1./s1

• Additionnal Information:

  IUPAC name: methyl (1S,2S,3R,5R)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate hydrochloride

• Shipping Conditions:

  Room Temperature

• CAS Number:

  113775-05-6