Ethyl (1R,3S,4R,5R,6S)-5,6-dihydroxy-2-azabicyclo[2.2.2]octane-3-carboxylate
[CAS# 697289-68-2]

Identification

• Name: Ethyl (1R,3S,4R,5R,6S)-5,6-dihydroxy-2-azabicyclo[2.2.2]octane-3-carboxylate
• Synonyms: (1R,3S,4R,5R,6S)-ethyl 5,6-dihydroxy-2-azabicyclo[2.2.2]octane-3-carboxylate
• Molecular Formula: C₁₀H₁₇NO₄
• Molecular Weight: 215.25
• CAS Registry Number: 697289-68-2
• SMILES: CCOC(=O)[C@@H]1[C@H]2CC[C@@H](N1)[C@@H]([C@@H]2O)O
• InChI: 1S/C10H17NO4/c1-2-15-10(14)7-5-3-4-6(11-7)9(13)8(5)12/h5-9,11-13H,2-4H2,1H3/t5-,6-,7+,8-,9+/m1/s1
• InChIKey: BSRNTNWGLCIJSC-ZEBDFXRSSA-N

Properties

• Density: 1.288g/cm³ (Cal.)
• Boiling point: 346.674°C at 760 mmHg (Cal.)
• Flash point: 163.463°C (Cal.)
• Refractive index: 1.54 (Cal.)