(3S,4R)-3-{[4-(Benzyloxy)-3-methoxyphenoxy]methyl}-4-(4-fluorophenyl)-1-methylpiperidine
[CAS# 600135-83-9]

Identification

• Name: (3S,4R)-3-{[4-(Benzyloxy)-3-methoxyphenoxy]methyl}-4-(4-fluorophenyl)-1-methylpiperidine
• Synonyms: (3S,4R)-4-(4-Fluorophenyl)-3-[[3-methoxy-4-(benzyloxy)phenoxy]methyl]-1-methylpiperidine
• Molecular Formula: C₂₇H₃₀FNO₃
• Molecular Weight: 435.53
• CAS Registry Number: 600135-83-9
• SMILES: CN1CC[C@H]([C@@H](C1)COc2ccc(c(c2)OC)OCc3ccccc3)c4ccc(cc4)F
• InChI: 1S/C27H30FNO3/c1-29-15-14-25(21-8-10-23(28)11-9-21)22(17-29)19-31-24-12-13-26(27(16-24)30-2)32-18-20-6-4-3-5-7-20/h3-13,16,22,25H,14-15,17-19H2,1-2H3/t22-,25-/m0/s1
• InChIKey: GVRONNVSYJRJGV-DHLKQENFSA-N

Properties

• Density: 1.134g/cm³ (Cal.)
• Boiling point: 549.925°C at 760 mmHg (Cal.)
• Flash point: 286.384°C (Cal.)
• Refractive index: 1.562 (Cal.)