(1alpha,3beta,4alpha,6alpha)-3-Hydroxy-3,7,7-Trimethylbicyclo[4.1.0]Hept-4-Yl Acetate
[CAS# 28435-84-9]

Identification

• Name: (1alpha,3beta,4alpha,6alpha)-3-Hydroxy-3,7,7-Trimethylbicyclo[4.1.0]Hept-4-Yl Acetate
• Synonyms: [(1R,3S,4S,6S)-4-Hydroxy-4,7,7-Trimethyl-Norcaran-3-Yl] Acetate; Acetic Acid [(1R,3S,4S,6S)-4-Hydroxy-4,7,7-Trimethyl-3-Norcaranyl] Ester; Acetic Acid [(1R,3S,4S,6S)-4-Hydroxy-4,7,7-Trimethyl-Norcaran-3-Yl] Ester
• Molecular Formula: C₁₂H₂₀O₃
• Molecular Weight: 212.29
• CAS Registry Number: 28435-84-9
• EINECS: 249-017-7
• SMILES: [C@H]12[C@H](C1(C)C)C[C@@H]([C@](C2)(O)C)OC(=O)C
• InChI: 1S/C12H20O3/c1-7(13)15-10-5-8-9(11(8,2)3)6-12(10,4)14/h8-10,14H,5-6H2,1-4H3/t8-,9+,10+,12+/m1/s1
• InChIKey: ULLVLQDHBOHWGJ-WDCWCFNPSA-N

Properties

• Density: 1.101g/cm³ (Cal.)
• Boiling point: 263.303°C at 760 mmHg (Cal.)
• Flash point: 98.835°C (Cal.)