Isopulegyl Acetate
[CAS# 89-49-6]

Identification

• Classification: Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyridine compound >> Aminopyridine
• Name: Isopulegyl Acetate
• Synonyms: [(1R,2S,5R)-2-Isopropenyl-5-Methyl-Cyclohexyl] Acetate; Acetic Acid [(1R,2S,5R)-2-Isopropenyl-5-Methylcyclohexyl] Ester; Acetic Acid [(1R,2S,5R)-2-Isopropenyl-5-Methyl-Cyclohexyl] Ester
• Molecular Formula: C₁₂H₂₀O₂
• Molecular Weight: 196.29
• CAS Registry Number: 89-49-6
• SMILES: [C@H]1(OC(=O)C)[C@@H](CC[C@H](C1)C)C(=C)C
• InChI: 1S/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9-,11+,12-/m1/s1
• InChIKey: HLHIVJRLODSUCI-ADEWGFFLSA-N

Properties

• Density: 0.942g/cm³ (Cal.)
• Boiling point: 248.007°C at 760 mmHg (Cal.)
• Flash point: 85.556°C (Cal.)