2-(Dimethylamino)-2-Phenylbutyl (-)-3,4,5-Trimethoxybenzoate
[CAS# 58997-88-9]

Identification

• Name: 2-(Dimethylamino)-2-Phenylbutyl (-)-3,4,5-Trimethoxybenzoate
• Synonyms: 2-Dimethylamino-3,4,5-Trimethoxy-Benzoic Acid 2-Phenylbutyl Ester; 2-Phenylbutyl 2-Dimethylamino-3,4,5-Trimethoxy-Benzoate; 2-Dimethylamino-3,4,5-Trimethoxybenzoic Acid 2-Phenylbutyl Ester
• Molecular Formula: C₂₂H₂₉NO₅
• Molecular Weight: 387.47
• CAS Registry Number: 58997-88-9
• EINECS: 261-546-5
• SMILES: C1=C(C(=C(C(=C1C(OCC(C2=CC=CC=C2)CC)=O)N(C)C)OC)OC)OC
• InChI: 1S/C22H29NO5/c1-7-15(16-11-9-8-10-12-16)14-28-22(24)17-13-18(25-4)20(26-5)21(27-6)19(17)23(2)3/h8-13,15H,7,14H2,1-6H3
• InChIKey: XRINAHRTJYGJSX-UHFFFAOYSA-N

Properties

• Density: 1.112g/cm³ (Cal.)
• Boiling point: 502.679°C at 760 mmHg (Cal.)
• Flash point: 257.811°C (Cal.)