2-[(3R,4S)-3-(1,3-Benzodioxol-5-Yloxymethyl)-4-(4-Fluorophenyl)Piperidin-1-Yl]-1-(4-Fluorophenyl)Ethanone
[CAS# 176894-09-0]

Identification

• Name: 2-[(3R,4S)-3-(1,3-Benzodioxol-5-Yloxymethyl)-4-(4-Fluorophenyl)Piperidin-1-Yl]-1-(4-Fluorophenyl)Ethanone
• Synonyms: 2-[(3R,4S)-3-(1,3-Benzodioxol-5-Yloxymethyl)-4-(4-Fluorophenyl)-1-Piperidyl]-1-(4-Fluorophenyl)Ethanone; 2-[(3R,4S)-3-(1,3-Benzodioxol-5-Yloxymethyl)-4-(4-Fluorophenyl)-1-Piperidinyl]-1-(4-Fluorophenyl)Ethanone; 4'-Fluoro-2-(Trans-4-(P-Fluorophenyl)-3-((3,4-(Methylenedioxy)Phenoxy)Methyl)-Piperidino)Acetophenone.
• Molecular Formula: C₂₇H₂₅F₂NO₄
• Molecular Weight: 465.50
• CAS Registry Number: 176894-09-0
• SMILES: [C@H]2([C@H](CN(CC(C1=CC=C(F)C=C1)=O)CC2)COC4=CC3=C(OCO3)C=C4)C5=CC=C(F)C=C5
• InChI: 1S/C27H25F2NO4/c28-21-5-1-18(2-6-21)24-11-12-30(15-25(31)19-3-7-22(29)8-4-19)14-20(24)16-32-23-9-10-26-27(13-23)34-17-33-26/h1-10,13,20,24H,11-12,14-17H2/t20-,24-/m1/s1
• InChIKey: FAHGZANUNVVDFL-HYBUGGRVSA-N

Properties

• Density: 1.266g/cm³ (Cal.)
• Boiling point: 587.165°C at 760 mmHg (Cal.)
• Flash point: 308.906°C (Cal.)