2-Methyl-5-(1-Methylethenyl)-2-Cyclohexen-1-Ol 1-Propanoate
[CAS# 97-45-0]

Identification

• Classification: Flavors and spices >> Synthetic spice >> Carboxylic acid and ester perfume >> Aliphatic carboxylate
• Name: 2-Methyl-5-(1-Methylethenyl)-2-Cyclohexen-1-Ol 1-Propanoate
• Synonyms: (5-Isopropenyl-2-Methyl-1-Cyclohex-2-Enyl) Propanoate; Propanoic Acid (5-Isopropenyl-2-Methyl-1-Cyclohex-2-Enyl) Ester; Propionic Acid (5-Isopropenyl-2-Methyl-1-Cyclohex-2-Enyl) Ester
• Molecular Formula: C₁₃H₂₀O₂
• Molecular Weight: 208.30
• CAS Registry Number: 97-45-0
• EINECS: 202-583-9
• FEMA: 2251
• SMILES: C(C(OC1CC(CC=C1C)C(C)=C)=O)C
• InChI: 1S/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3
• InChIKey: DFVXNZOMAOGTBL-UHFFFAOYSA-N

Properties

• Density: 0.958g/cm³ (Cal.)
• Boiling point: 287.546°C at 760 mmHg (Cal.)
• Flash point: 107.778°C (Cal.)