3,4,5-Trimethoxybenzoic Acid 4-[N-Butyl-N-(4-Hydroxy-alpha-Methylphenethyl)Amino]Butyl Ester
[CAS# 67293-59-8]

Identification

• Name: 3,4,5-Trimethoxybenzoic Acid 4-[N-Butyl-N-(4-Hydroxy-alpha-Methylphenethyl)Amino]Butyl Ester
• Synonyms: 4-[Butyl-[2-(4-Hydroxyphenyl)-1-Methyl-Ethyl]Amino]Butyl 3,4,5-Trimethoxybenzoate; 3,4,5-Trimethoxybenzoic Acid 4-[Butyl-[2-(4-Hydroxyphenyl)-1-Methylethyl]Amino]Butyl Ester; 3,4,5-Trimethoxybenzoic Acid 4-[Butyl-[2-(4-Hydroxyphenyl)-1-Methyl-Ethyl]Amino]Butyl Ester
• Molecular Formula: C₂₇H₃₉NO₆
• Molecular Weight: 473.61
• CAS Registry Number: 67293-59-8
• SMILES: C1=C(C(=C(C=C1C(=O)OCCCCN(C(CC2=CC=C(C=C2)O)C)CCCC)OC)OC)OC
• InChI: 1S/C27H39NO6/c1-6-7-14-28(20(2)17-21-10-12-23(29)13-11-21)15-8-9-16-34-27(30)22-18-24(31-3)26(33-5)25(19-22)32-4/h10-13,18-20,29H,6-9,14-17H2,1-5H3
• InChIKey: ZDZIJSNEAPLQJU-UHFFFAOYSA-N

Properties

• Density: 1.098g/cm³ (Cal.)
• Boiling point: 571.139°C at 760 mmHg (Cal.)
• Flash point: 299.214°C (Cal.)