(R)-Pseudococaine
[CAS# 478-73-9]

Identification

• Name: (R)-Pseudococaine
• Synonyms: (1R,2S,3S,5S)-8-Methyl-3-(Oxo-Phenylmethoxy)-8-Azabicyclo[3.2.1]Octane-2-Carboxylic Acid Methyl Ester; (1R,2S,3S,5S)-3-(Benzoyloxy)-8-Methyl-8-Azabicyclo[3.2.1]Octane-2-Carboxylic Acid Methyl Ester; Methyl (1R,2S,3S,5S)-8-Methyl-3-Phenylcarbonyloxy-8-Azabicyclo[3.2.1]Octane-2-Carboxylate
• Molecular Formula: C₁₇H₂₁NO₄
• Molecular Weight: 303.36
• CAS Registry Number: 478-73-9
• SMILES: [C@H]12[C@@H]([C@H](C[C@H](CC1)N2C)OC(C3=CC=CC=C3)=O)C(=O)OC
• InChI: 1S/C17H21NO4/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/t12-,13+,14-,15-/m0/s1
• InChIKey: ZPUCINDJVBIVPJ-XGUBFFRZSA-N

Properties

• Density: 1.223g/cm³ (Cal.)
• Boiling point: 395.189°C at 760 mmHg (Cal.)
• Flash point: 192.804°C (Cal.)