1-[(1R,8S,9S)-Bicyclo[6.1.0]Nona-2,4,6-Trien-9-Yl]Ethanone
[CAS# 259656-27-4]

Identification

• Name: 1-[(1R,8S,9S)-Bicyclo[6.1.0]Nona-2,4,6-Trien-9-Yl]Ethanone
• Synonyms: 1-((1R,2Z,4Z,6Z,8S,9r)-bicyclo[6.1.0]nona-2,4,6-trien-9-yl)ethanone
• Molecular Formula: C₁₁H₁₂O
• Molecular Weight: 160.21
• CAS Registry Number: 259656-27-4
• SMILES: CC(=O)[C@@H]1[C@@H]/2[C@H]1/C=C\C=C/C=C2
• InChI: 1S/C11H12O/c1-8(12)11-9-6-4-2-3-5-7-10(9)11/h2-7,9-11H,1H3/b3-2-,6-4-,7-5-/t9-,10+,11+
• InChIKey: QXTZHXBDKTWUNS-KEHBHHSYSA-N

Properties

• Density: 1.055g/cm³ (Cal.)
• Boiling point: 263.501°C at 760 mmHg (Cal.)
• Flash point: 107.696°C (Cal.)
• Refractive index: 1.539 (Cal.)