N-Allylnorcocaine
[CAS# 66964-29-2]

Identification

• Name: N-Allylnorcocaine
• Synonyms: Methyl (1R)-8-Allyl-3-Benzoyloxy-8-Azabicyclo[3.2.1]Octane-2-Carboxylate Hydrochloride; (1R)-8-Allyl-3-Benzoyloxy-8-Azabicyclo[3.2.1]Octane-2-Carboxylic Acid Methyl Ester Hydrochloride; Methyl (1R)-3-(Phenylcarbonyloxy)-8-Prop-2-Enyl-8-Azabicyclo[3.2.1]Octane-2-Carboxylate Hydrochloride
• Molecular Formula: C₁₉H₂₄ClNO₄
• Molecular Weight: 365.86
• CAS Registry Number: 66964-29-2 (69610-27-1)
• SMILES: [C@H]23N(C(CC(OC(=O)C1=CC=CC=C1)C2C(OC)=O)CC3)CC=C.[H+].[Cl-]
• InChI: 1S/C19H23NO4.ClH/c1-3-11-20-14-9-10-15(20)17(19(22)23-2)16(12-14)24-18(21)13-7-5-4-6-8-13;/h3-8,14-17H,1,9-12H2,2H3;1H/t14?,15-,16?,17?;/m1./s1
• InChIKey: SMKTZQCLCMCHPR-DQFZGLBTSA-N

Properties

• Boiling point: 420.3°C at 760 mmHg (Cal.)
• Flash point: 208°C (Cal.)