3-[4-[3-(3,4,5-Trimethoxybenzoyl)Oxypropyl]-1,4-Diazepan-1-Yl]Propyl 3,4,5-Trimethoxybenzoate
[CAS# 35898-87-4]

Identification

• Name: 3-[4-[3-(3,4,5-Trimethoxybenzoyl)Oxypropyl]-1,4-Diazepan-1-Yl]Propyl 3,4,5-Trimethoxybenzoate
• Synonyms: 3,4,5-Trimethoxybenzoic Acid 3-[4-[3-[Oxo-(3,4,5-Trimethoxyphenyl)Methoxy]Propyl]-1,4-Diazepan-1-Yl]Propyl Ester; 3,4,5-Trimethoxybenzoic Acid 3-[4-[3-(3,4,5-Trimethoxybenzoyl)Oxypropyl]-1,4-Diazepan-1-Yl]Propyl Ester; 3-[4-[3-(3,4,5-Trimethoxyphenyl)Carbonyloxypropyl]-1,4-Diazepan-1-Yl]Propyl 3,4,5-Trimethoxybenzoate
• Molecular Formula: C₃₁H₄₄N₂O₁₀
• Molecular Weight: 604.70
• CAS Registry Number: 35898-87-4
• SMILES: C1=C(C=C(OC)C(=C1OC)OC)C(OCCCN3CCN(CCCOC(C2=CC(=C(OC)C(=C2)OC)OC)=O)CCC3)=O
• InChI: 1S/C31H44N2O10/c1-36-24-18-22(19-25(37-2)28(24)40-5)30(34)42-16-8-12-32-10-7-11-33(15-14-32)13-9-17-43-31(35)23-20-26(38-3)29(41-6)27(21-23)39-4/h18-21H,7-17H2,1-6H3
• InChIKey: QVZCXCJXTMIDME-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 646.0±55.0°C at 760 mmHg (Cal.)
• Flash point: 344.5±31.5°C (Cal.)