(4R,5S,7S)-5-Ethyl-7-[(R)-Hydroxy-(6-Methoxyquinolin-4-Yl)Methyl]-1-Azabicyclo[2.2.2]Octan-5-Ol
[CAS# 78523-30-5]

Identification

• Name: (4R,5S,7S)-5-Ethyl-7-[(R)-Hydroxy-(6-Methoxyquinolin-4-Yl)Methyl]-1-Azabicyclo[2.2.2]Octan-5-Ol
• Synonyms: (3S,4R,6S)-3-Ethyl-6-[(R)-Hydroxy-(6-Methoxy-4-Quinolyl)Methyl]Quinuclidin-3-Ol; (3S,4R,6S)-3-Ethyl-6-[(R)-Hydroxy-(6-Methoxy-4-Quinolyl)Methyl]-3-Quinuclidinol; 3-Hydroxydihydroquinine
• Molecular Formula: C₂₀H₂₆N₂O₃
• Molecular Weight: 342.44
• CAS Registry Number: 78523-30-5
• SMILES: [C@@H](C1=CC=NC2=CC=C(C=C12)OC)([C@H]3N4C[C@@]([C@@H](C3)CC4)(CC)O)O
• InChI: 1S/C20H26N2O3/c1-3-20(24)12-22-9-7-13(20)10-18(22)19(23)15-6-8-21-17-5-4-14(25-2)11-16(15)17/h4-6,8,11,13,18-19,23-24H,3,7,9-10,12H2,1-2H3/t13-,18+,19-,20-/m1/s1
• InChIKey: QJYVSAYVZYKUJL-ZNYHDOEXSA-N

Properties

• Density: 1.277g/cm³ (Cal.)
• Boiling point: 536.285°C at 760 mmHg (Cal.)
• Flash point: 278.135°C (Cal.)