2,7,7-Trimethylbicyclo[3.1.1]hept-2-en-6-ol acetate
[CAS# 54324-99-1]

Identification

• Name: 2,7,7-Trimethylbicyclo[3.1.1]hept-2-en-6-ol acetate
• Synonyms: Acetic Acid (4,7,7-Trimethyl-6-Bicyclo[3.1.1]Hept-3-Enyl) Ester; (4,7,7-Trimethyl-6-Bicyclo[3.1.1]Hept-3-Enyl) Ethanoate; (+)-Trans-Chrysanthenyl Acetate
• Molecular Formula: C₁₂H₁₈O₂
• Molecular Weight: 194.27
• CAS Registry Number: 54324-99-1
• SMILES: CC1(C2C(OC(=O)C)C1CC=C2C)C
• InChI: 1S/C12H18O2/c1-7-5-6-9-11(14-8(2)13)10(7)12(9,3)4/h5,9-11H,6H2,1-4H3
• InChIKey: UASZOTVHPVEMQR-UHFFFAOYSA-N

Properties

• Density: 1.033g/cm³ (Cal.)
• Boiling point: 232.128°C at 760 mmHg (Cal.)
• Flash point: 85.298°C (Cal.)