Calyxol
[CAS# 59151-19-8]

Identification

• Name: Calyxol
• Synonyms: Ethyl 2-Methyl-4-Oxo-6-Pentyl-Cyclohex-2-Ene-1-Carboxylate; 2-Methyl-4-Oxo-6-Pentyl-1-Cyclohex-2-Enecarboxylic Acid Ethyl Ester; 6-Amyl-4-Keto-2-Methyl-Cyclohex-2-Ene-1-Carboxylic Acid Ethyl Ester
• Molecular Formula: C₁₅H₂₄O₃
• Molecular Weight: 252.35
• CAS Registry Number: 59151-19-8
• EINECS: 261-629-6
• SMILES: C(C1C(C(=CC(C1)=O)C)C(OCC)=O)CCCC
• InChI: 1S/C15H24O3/c1-4-6-7-8-12-10-13(16)9-11(3)14(12)15(17)18-5-2/h9,12,14H,4-8,10H2,1-3H3
• InChIKey: ZJLHQWGPVWXKME-UHFFFAOYSA-N

Properties

• Density: 0.988g/cm³ (Cal.)
• Boiling point: 345.933°C at 760 mmHg (Cal.)
• Flash point: 148.614°C (Cal.)