1-[2-(3,4-Dimethoxyphenyl)Ethyl]-4-Piperidinol 4-Benzoate Hydrochloride (1:1)
[CAS# 134826-28-1]

Identification

• Name: 1-[2-(3,4-Dimethoxyphenyl)Ethyl]-4-Piperidinol 4-Benzoate Hydrochloride (1:1)
• Synonyms: [1-[2-(3,4-Dimethoxyphenyl)Ethyl]-4-Piperidyl] Benzoate Hydrochloride; Benzoic Acid [1-[2-(3,4-Dimethoxyphenyl)Ethyl]-4-Piperidinyl] Ester Hydrochloride; Benzoic Acid (1-Homoveratryl-4-Piperidyl) Ester Hydrochloride
• Molecular Formula: C₂₂H₂₈ClNO₄
• Molecular Weight: 405.92
• CAS Registry Number: 134826-28-1
• SMILES: [H+].C1=C(OC)C(=CC=C1CCN3CCC(OC(=O)C2=CC=CC=C2)CC3)OC.[Cl-]
• InChI: 1S/C22H27NO4.ClH/c1-25-20-9-8-17(16-21(20)26-2)10-13-23-14-11-19(12-15-23)27-22(24)18-6-4-3-5-7-18;/h3-9,16,19H,10-15H2,1-2H3;1H
• InChIKey: LYXUJZCAWIJHME-UHFFFAOYSA-N

Properties

• Boiling point: 482.5°C at 760 mmHg (Cal.)
• Flash point: 245.6°C (Cal.)