1-Azabicyclo[2.2.2]Octan-8-Yl 1H-Xanthene-9-Carboxylate
[CAS# 102585-08-0]

Identification

• Name: 1-Azabicyclo[2.2.2]Octan-8-Yl 1H-Xanthene-9-Carboxylate
• Synonyms: Quinuclidin-3-Yl 1H-Xanthene-9-Carboxylate; 1H-Xanthene-9-Carboxylic Acid 3-Quinuclidinyl Ester; 1H-Xanthene-9-Carboxylic Acid Quinuclidin-3-Yl Ester
• Molecular Formula: C₂₁H₂₁NO₃
• Molecular Weight: 335.40
• CAS Registry Number: 102585-08-0
• SMILES: C1=CC=CC3=C1C(=C2C(=CC=CC2)O3)C(OC4C5CCN(C4)CC5)=O
• InChI: 1S/C21H21NO3/c23-21(25-19-13-22-11-9-14(19)10-12-22)20-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)20/h1-5,7-8,14,19H,6,9-13H2
• InChIKey: VWFBHVWTXINIBX-UHFFFAOYSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 527.105°C at 760 mmHg (Cal.)
• Flash point: 272.584°C (Cal.)