1-Phenethyl-4-Piperidinemethanol (3,4,5-Trimethoxybenzoate)
[CAS# 67361-19-7]

Identification

• Name: 1-Phenethyl-4-Piperidinemethanol (3,4,5-Trimethoxybenzoate)
• Synonyms: [1-(2-Phenylethyl)-4-Piperidyl]Methyl 3,4,5-Trimethoxybenzoate; 3,4,5-Trimethoxybenzoic Acid [1-(2-Phenylethyl)-4-Piperidinyl]Methyl Ester; 3,4,5-Trimethoxybenzoic Acid [1-(2-Phenylethyl)-4-Piperidyl]Methyl Ester
• Molecular Formula: C₂₄H₃₁NO₅
• Molecular Weight: 413.51
• CAS Registry Number: 67361-19-7
• SMILES: C1=C(C(=C(C=C1C(=O)OCC2CCN(CC2)CCC3=CC=CC=C3)OC)OC)OC
• InChI: 1S/C24H31NO5/c1-27-21-15-20(16-22(28-2)23(21)29-3)24(26)30-17-19-10-13-25(14-11-19)12-9-18-7-5-4-6-8-18/h4-8,15-16,19H,9-14,17H2,1-3H3
• InChIKey: WBWSOQUKLHOODY-UHFFFAOYSA-N

Properties

• Density: 1.114g/cm³ (Cal.)
• Boiling point: 498.665°C at 760 mmHg (Cal.)
• Flash point: 255.384°C (Cal.)