Ethyl 2-Acetyl-5,5-Dimethyl-4-Oxohexanoate
[CAS# 38453-93-9]

Identification

• Name: Ethyl 2-Acetyl-5,5-Dimethyl-4-Oxohexanoate
• Synonyms: 3-ETHOXYCARBONYL-1-(TERT-BUTYL)PENTANE-1,4-DIONE
• Molecular Formula: C₁₂H₂₀O₄
• Molecular Weight: 228.28
• CAS Registry Number: 38453-93-9
• SMILES: O=C(C(C(=O)OCC)CC(=O)C(C)(C)C)C
• InChI: 1S/C12H20O4/c1-6-16-11(15)9(8(2)13)7-10(14)12(3,4)5/h9H,6-7H2,1-5H3
• InChIKey: RNCMRWOMOSMYRA-UHFFFAOYSA-N

Properties

• Density: 1.016g/cm³ (Cal.)
• Boiling point: 323.565°C at 760 mmHg (Cal.)
• Flash point: 139.307°C (Cal.)