[(1S,4R,5S,8S)-4-Methyl-8-Bicyclo[3.3.1]Nonyl] Acetate
[CAS# 87362-54-7]

Identification

• Name: [(1S,4R,5S,8S)-4-Methyl-8-Bicyclo[3.3.1]Nonyl] Acetate
• Synonyms: Acetic Acid [(1S,4S,5S,8R)-8-Methyl-4-Bicyclo[3.3.1]Nonanyl] Ester; [(1S,4S,5S,8R)-8-Methyl-4-Bicyclo[3.3.1]Nonanyl] Ethanoate; Bicyclo(3.3.1)Nonan-1-Ol, 5-Methyl-, Acetate
• Molecular Formula: C₁₂H₂₀O₂
• Molecular Weight: 196.29
• CAS Registry Number: 87362-54-7
• SMILES: [C@H]1(OC(=O)C)CC[C@@H]2[C@@H](CC[C@H]1C2)C
• InChI: 1S/C12H20O2/c1-8-3-4-11-7-10(8)5-6-12(11)14-9(2)13/h8,10-12H,3-7H2,1-2H3/t8-,10+,11+,12+/m1/s1
• InChIKey: ITEANMPRYNDDDE-QTKMDUPCSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 246.862°C at 760 mmHg (Cal.)
• Flash point: 101.509°C (Cal.)