(5R)-3-Isobutyl-5-isopropenyl-2-methyl-2-cyclohexen-1-one
[CAS# 791854-72-3]

Identification

• Name: (5R)-3-Isobutyl-5-isopropenyl-2-methyl-2-cyclohexen-1-one
• Synonyms: (R)-3-isobutyl-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enone
• Molecular Formula: C₁₄H₂₂O
• Molecular Weight: 206.32
• CAS Registry Number: 791854-72-3
• SMILES: O=C1/C(=C(/CC(C)C)C[C@@H](\C(=C)C)C1)C
• InChI: 1S/C14H22O/c1-9(2)6-13-7-12(10(3)4)8-14(15)11(13)5/h9,12H,3,6-8H2,1-2,4-5H3/t12-/m1/s1
• InChIKey: SXPIDGCCBJFUCQ-GFCCVEGCSA-N

Properties

• Density: 0.902g/cm³ (Cal.)
• Boiling point: 293.52°C at 760 mmHg (Cal.)
• Flash point: 131.661°C (Cal.)
• Refractive index: 1.471 (Cal.)