Bufenadrine
[CAS# 604-74-0]

Identification

• Name: Bufenadrine
• Synonyms: 2-[(2-Tert-Butylphenyl)-Phenyl-Methoxy]-N,N-Dimethyl-Ethanamine; 2-[(2-Tert-Butylphenyl)-Phenyl-Methoxy]Ethyl-Dimethyl-Amine; 2-((O-Tert-Butyl-Alpha-Phenyl-Benzyl)Oxy)-N,N-Dimethylethylamine.
• Molecular Formula: C₂₁H₂₉NO
• Molecular Weight: 311.47
• CAS Registry Number: 604-74-0
• SMILES: C2=C(C(C1=CC=CC=C1)OCCN(C)C)C(=CC=C2)C(C)(C)C
• InChI: 1S/C21H29NO/c1-21(2,3)19-14-10-9-13-18(19)20(23-16-15-22(4)5)17-11-7-6-8-12-17/h6-14,20H,15-16H2,1-5H3
• InChIKey: OGNRRAFRDFGFKA-UHFFFAOYSA-N

Properties

• Density: 0.986g/cm³ (Cal.)
• Boiling point: 392.054°C at 760 mmHg (Cal.)
• Flash point: 115.403°C (Cal.)