3,4,5-Trimethoxybenzoic Acid 4-(Phenethylamino)Butyl Ester
[CAS# 67293-55-4]

Identification

• Name: 3,4,5-Trimethoxybenzoic Acid 4-(Phenethylamino)Butyl Ester
• Synonyms: 3,4,5-Trimethoxybenzoic Acid 4-(2-Phenylethylamino)Butyl Ester; Benzoic Acid, 3,4,5-Trimethoxy-, 4-(N-Phenethylamino)Butyl Ester; N-(4-Hydroxybutyl)Phenethylamine 3,4,5-Trimethoxybenzoate
• Molecular Formula: C₂₂H₂₉NO₅
• Molecular Weight: 387.47
• CAS Registry Number: 67293-55-4
• SMILES: C1=C(C(=C(C=C1C(=O)OCCCCNCCC2=CC=CC=C2)OC)OC)OC
• InChI: 1S/C22H29NO5/c1-25-19-15-18(16-20(26-2)21(19)27-3)22(24)28-14-8-7-12-23-13-11-17-9-5-4-6-10-17/h4-6,9-10,15-16,23H,7-8,11-14H2,1-3H3
• InChIKey: JTMVUXFFFIFMJM-UHFFFAOYSA-N

Properties

• Density: 1.103g/cm³ (Cal.)
• Boiling point: 491.932°C at 760 mmHg (Cal.)
• Flash point: 251.312°C (Cal.)