(3S,4R)-3-{[4-(Benzyloxy)-3-methoxyphenoxy]methyl}-4-(4-fluorophenyl)piperidine
[CAS# 600135-89-5]

Identification

• Name: (3S,4R)-3-{[4-(Benzyloxy)-3-methoxyphenoxy]methyl}-4-(4-fluorophenyl)piperidine
• Molecular Formula: C₂₆H₂₈FNO₃
• Molecular Weight: 421.50
• CAS Registry Number: 600135-89-5
• SMILES: COc1cc(ccc1OCc2ccccc2)OC[C@@H]3CNCC[C@H]3c4ccc(cc4)F
• InChI: 1S/C26H28FNO3/c1-29-26-15-23(11-12-25(26)31-17-19-5-3-2-4-6-19)30-18-21-16-28-14-13-24(21)20-7-9-22(27)10-8-20/h2-12,15,21,24,28H,13-14,16-18H2,1H3/t21-,24-/m0/s1
• InChIKey: JJJAIRUIVLJSHY-URXFXBBRSA-N

Properties

• Density: 1.142g/cm³ (Cal.)
• Boiling point: 556.403°C at 760 mmHg (Cal.)
• Flash point: 290.302°C (Cal.)
• Refractive index: 1.562 (Cal.)