3-[(1R,5S)-9-Methoxy-3-(2-phenylethyl)-3-azabicyclo[3.3.1]nonan-9-yl]phenol
[CAS# 42471-70-5]

Identification

• Name: 3-[(1R,5S)-9-Methoxy-3-(2-phenylethyl)-3-azabicyclo[3.3.1]nonan-9-yl]phenol
• Synonyms: Phenol, 3-(9-Methoxy-3-(2-Phenylethyl)-3-Azabicyclo(3.3.1)Non-9-Yl)-, Syn-; Phenol, 3-(9-Methoxy-3-Phenethyl-3-Azabicyclo(3.3.1)Non-9-Yl)-, Syn-; Syn-3-(9-Methoxy-3-Phenethyl-3-Azabicyclo(3.3.1)Non-9-Yl)Phenol
• Molecular Formula: C₂₃H₂₉NO₂
• Molecular Weight: 351.49
• CAS Registry Number: 42471-70-5
• SMILES: [C@@H]13C(OC)([C@@H](CN(C1)CCC2=CC=CC=C2)CCC3)C4=CC(=CC=C4)O
• InChI: 1S/C23H29NO2/c1-26-23(19-9-6-12-22(25)15-19)20-10-5-11-21(23)17-24(16-20)14-13-18-7-3-2-4-8-18/h2-4,6-9,12,15,20-21,25H,5,10-11,13-14,16-17H2,1H3/t20-,21+,23?
• InChIKey: UXFOUDJIDGKJDT-TYABSZSSSA-N

Properties

• Density: 1.159g/cm³ (Cal.)
• Boiling point: 495.874°C at 760 mmHg (Cal.)
• Flash point: 253.696°C (Cal.)