N-Demethyl Cocaethylene Hydrochloride

• Synonyms:

  (1R,2R,3S,5S)-3-(Benzoyloxy)-8-azabicyclo[3.2.1]octane-2-carboxylic Acid Ethyl Ester Hydrochloride; [1R-(exo,exo)]-3-(Benzoyloxy)-8-azabicyclo[3.2.1]octane-2-carboxylic Acid Ethyl Ester Hydrochloride; N-Demethylcocaethyline Hydrochloride; Norcocaethylene Hydrochloride; Norcocaethyline Hydrochloride; Norethylcocaine Hydrochloride; Norhomococaine Hydrochloride;

• Hazard Statement:

  Toxic if swallowed; UN number: UN2811; Packing Group: III

• Smiles:

  O=C(C1=CC=CC=C1)O[C@@H]2[C@@H]([C@]3([H])N[C@](CC3)([H])C2)C(OCC)=O.Cl

• Molecular Formula:

  C17H21NO4.HCl

• Molecular Weight:

  339.82

• InChI:

  InChI=1S/C17H21NO4.ClH/c1-2-21-17(20)15-13-9-8-12(18-13)10-14(15)22-16(19)11-6-4-3-5-7-11;/h3-7,12-15,18H,2,8-10H2,1H3;1H/t12-,13+,14-,15+;/m0./s1

• Additionnal Information:

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

• Shipping Conditions:

  Room Temperature

• CAS Number:

  362044-01-7