(3S)-7-Bromo-1,2,3,8b-Tetrahydro-3,6,8bbeta-Trimethyl-3aH-Cyclopenta[b]Benzofuran-3abeta-Methanol
[CAS# 6790-64-3]

Identification

• Name: (3S)-7-Bromo-1,2,3,8b-Tetrahydro-3,6,8bbeta-Trimethyl-3aH-Cyclopenta[b]Benzofuran-3abeta-Methanol
• Synonyms: [(3S,3As,8Bs)-7-Bromo-3,6,8B-Trimethyl-2,3-Dihydro-1H-Cyclopenta[B]Benzofuran-3A-Yl]Methanol; 3Ah-Cyclopenta(B)Benzofuran-3A-Methanol, 7-Bromo-1,2,3,8B-Tetrahydro-3,6,8B-Trimethyl-, (3Alpha,3Abeta,8Bbeta)-(-)-; 7-Bromo-1,2,3,8B-Tetrahydro-3,6,8B-Trimethyl-3Ah-Cyclopenta(B)Benzofuran-3A-Methanol (3Alpha,3Abeta,8Bbeta)-(-)-
• Molecular Formula: C₁₅H₁₉BrO₂
• Molecular Weight: 311.22
• CAS Registry Number: 6790-64-3
• SMILES: [C@]13([C@@](OC2=C1C=C(Br)C(=C2)C)([C@H](CC3)C)CO)C
• InChI: 1S/C15H19BrO2/c1-9-6-13-11(7-12(9)16)14(3)5-4-10(2)15(14,8-17)18-13/h6-7,10,17H,4-5,8H2,1-3H3/t10-,14-,15-/m0/s1
• InChIKey: QKBMCQNYERBGHD-LKTVYLICSA-N

Properties

• Density: 1.387g/cm³ (Cal.)
• Boiling point: 386.906°C at 760 mmHg (Cal.)
• Flash point: 187.794°C (Cal.)

References

• (1): D. A. Clemente and A. Marzotto. 22 Space-group changes, Acta Cryst. (2003). B59, 43-50