(2S)-6-Ethoxy-1,6-dioxo-2-hexanyl benzoate
[CAS# 82493-58-1]

Identification

• Name: (2S)-6-Ethoxy-1,6-dioxo-2-hexanyl benzoate
• Synonyms: ETHYL-(5S)-BENZOYLOXY6-OXOHEXENOATE
• Molecular Formula: C₁₅H₁₈O₅
• Molecular Weight: 278.30
• CAS Registry Number: 82493-58-1
• SMILES: CCOC(=O)CCC[C@@H](C=O)OC(=O)C1=CC=CC=C1
• InChI: 1S/C15H18O5/c1-2-19-14(17)10-6-9-13(11-16)20-15(18)12-7-4-3-5-8-12/h3-5,7-8,11,13H,2,6,9-10H2,1H3/t13-/m0/s1
• InChIKey: GNGWLCLWAZJBBV-ZDUSSCGKSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 400.5±40.0°C at 760 mmHg (Cal.)
• Flash point: 176.2±27.4°C (Cal.)