4-Oxo-4-({1-[2-(2-phenylethyl)phenoxy]-3-(1-piperidinyl)-2-propanyl}oxy)butanoic acid hydrochloride (1:1)
[CAS# 86819-29-6]

Identification

• Name: 4-Oxo-4-({1-[2-(2-phenylethyl)phenoxy]-3-(1-piperidinyl)-2-propanyl}oxy)butanoic acid hydrochloride (1:1)
• Synonyms: 2-((3-Piperidino-2-(3-carboxypropionyloxy))propoxy)bibenzyl hydrochloride; Butanedioic acid, mono(1-((2-(2-phenylethyl)phenoxy)methyl)-2-(1-piperidinyl)ethyl) ester, hydrochloride
• Molecular Formula: C₂₆H₃₄ClNO₅
• Molecular Weight: 476.00
• CAS Registry Number: 86819-29-6
• SMILES: Cl.O=C(O)CCC(=O)OC(CN1CCCCC1)COc2ccccc2CCc3ccccc3
• InChI: 1S/C26H33NO5.ClH/c28-25(29)15-16-26(30)32-23(19-27-17-7-2-8-18-27)20-31-24-12-6-5-11-22(24)14-13-21-9-3-1-4-10-21;/h1,3-6,9-12,23H,2,7-8,13-20H2,(H,28,29);1H
• InChIKey: NCPBQPHLYNIIPJ-UHFFFAOYSA-N

Properties

• Boiling point: 610.7°C at 760 mmHg (Cal.)
• Flash point: 323.1°C (Cal.)