2-Carbethoxy-2-(beta-Phenylethyl)Cyclooctanone
[CAS# 52186-03-5]

Identification

• Name: 2-Carbethoxy-2-(beta-Phenylethyl)Cyclooctanone
• Synonyms: 2-Oxo-1-(2-Phenylethyl)-1-Cyclooctanecarboxylic Acid Ethyl Ester; 2-Keto-1-(2-Phenylethyl)Cyclooctane-1-Carboxylic Acid Ethyl Ester; 2-Carbethoxy-2-(Beta-Phenylethyl)Cyclooctanone
• Molecular Formula: C₁₉H₂₆O₃
• Molecular Weight: 302.41
• CAS Registry Number: 52186-03-5
• SMILES: C1=CC=CC=C1CCC2(C(CCCCCC2)=O)C(=O)OCC
• InChI: 1S/C19H26O3/c1-2-22-18(21)19(14-9-4-3-8-12-17(19)20)15-13-16-10-6-5-7-11-16/h5-7,10-11H,2-4,8-9,12-15H2,1H3
• InChIKey: LFHWQJCOAQWRSZ-UHFFFAOYSA-N

Properties

• Density: 1.045g/cm³ (Cal.)
• Boiling point: 417.36°C at 760 mmHg (Cal.)
• Flash point: 181.028°C (Cal.)