Ethyl 3-(2,2-dimethylbutanoyl)benzoate
[CAS# 898765-22-5]

Identification

• Name: Ethyl 3-(2,2-dimethylbutanoyl)benzoate
• Synonyms: 3'-carboethoxy-2,2-dimethylbutyrophenone
• Molecular Formula: C₁₅H₂₀O₃
• Molecular Weight: 248.32
• CAS Registry Number: 898765-22-5
• SMILES: O=C(OCC)c1cccc(c1)C(=O)C(C)(C)CC
• InChI: 1S/C15H20O3/c1-5-15(3,4)13(16)11-8-7-9-12(10-11)14(17)18-6-2/h7-10H,5-6H2,1-4H3
• InChIKey: DXWHYQFXAKTWSA-UHFFFAOYSA-N

Properties

• Density: 1.029g/cm³ (Cal.)
• Boiling point: 353.758°C at 760 mmHg (Cal.)
• Flash point: 153.405°C (Cal.)
• Refractive index: 1.501 (Cal.)