(5-Ethyl-1-Azabicyclo[2.2.2]Oct-2-Yl)Methanol
[CAS# 219794-81-7]

Identification

• Name: (5-Ethyl-1-Azabicyclo[2.2.2]Oct-2-Yl)Methanol
• Synonyms: (2R,4S,5R)-2-Hydroxymethyl-5-ethylquinuclidine; 1-AZABICYCLO[2.2.2]OCTANE-2-METHANOL,5-ETHYL-, (1S,2R,4S,5R)-
• Molecular Formula: C₁₀H₁₉NO
• Molecular Weight: 169.26
• CAS Registry Number: 219794-81-7
• SMILES: OCC1N2CCC(C1)C(CC)C2
• InChI: 1S/C10H19NO/c1-2-8-6-11-4-3-9(8)5-10(11)7-12/h8-10,12H,2-7H2,1H3
• InChIKey: CWZWBZXPEJJRSS-UHFFFAOYSA-N

Properties

• Density: 1.042g/cm³ (Cal.)
• Boiling point: 252.612°C at 760 mmHg (Cal.)
• Flash point: 106.003°C (Cal.)
• Refractive index: 1.522 (Cal.)

References

• (1): Over et al.. Natural-product-derived fragments for fragment-based ligand discovery, Nature Chemistry, 2012