5-Bromotricyclo[8.2.2.2^4,7]Hexadeca-1(12),4,6,10,13,15-Hexaene
[CAS# 1908-61-8]

Identification

• Name: 5-Bromotricyclo[8.2.2.2^4,7]Hexadeca-1(12),4,6,10,13,15-Hexaene
• Synonyms: 5-bromotricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
• Molecular Formula: C₁₆H₁₅Br
• Molecular Weight: 287.19
• CAS Registry Number: 1908-61-8
• SMILES: C1CC2=CC(=C(CCC3=CC=C1C=C3)C=C2)Br
• InChI: 1S/C16H15Br/c17-16-11-14-6-5-12-1-3-13(4-2-12)7-9-15(16)10-8-14/h1-4,8,10-11H,5-7,9H2
• InChIKey: RJOYWTPJYZNRJD-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 370.5±31.0°C at 760 mmHg (Cal.)
• Flash point: 174.6±19.3°C (Cal.)
• Refractive index: 1.608 (Cal.)

References

• (1): Alex J. Roche and Belgin Canturk. An exploration of Suzuki aryl cross coupling chemistry involving [2.2]paracyclophane derivatives, Org. Biomol. Chem., 2005, 3, 515.