4-Bromo-alpha-(Hydroxymethyl)Benzeneacetic Acid 8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl Ester
[CAS# 63978-22-3]

Identification

• Name: 4-Bromo-alpha-(Hydroxymethyl)Benzeneacetic Acid 8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl Ester
• Synonyms: (8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl) 2-(4-Bromophenyl)-3-Hydroxy-Propanoate; 2-(4-Bromophenyl)-3-Hydroxypropanoic Acid (8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl) Ester; 2-(4-Bromophenyl)-3-Hydroxy-Propionic Acid (8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl) Ester
• Molecular Formula: C₁₇H₂₂BrNO₃
• Molecular Weight: 368.27
• CAS Registry Number: 63978-22-3
• SMILES: C3=C(C(C(OC1CC2N(C(C1)CC2)C)=O)CO)C=CC(=C3)Br
• InChI: 1S/C17H22BrNO3/c1-19-13-6-7-14(19)9-15(8-13)22-17(21)16(10-20)11-2-4-12(18)5-3-11/h2-5,13-16,20H,6-10H2,1H3
• InChIKey: HMXQSWAWRXDIOX-UHFFFAOYSA-N

Properties

• Density: 1.443g/cm³ (Cal.)
• Boiling point: 472.379°C at 760 mmHg (Cal.)
• Flash point: 239.487°C (Cal.)