Ethyl 2-Benzoyl-5-Methyl-Hexanoate
[CAS 6305-62-0]

Identification

• Name: Ethyl 2-Benzoyl-5-Methyl-Hexanoate
• Synonyms: Ethyl 2-(Benzoyl)-5-Methyl-Hexanoate; 5-Methyl-2-(Oxo-Phenylmethyl)Hexanoic Acid Ethyl Ester; 2-(Benzoyl)-5-Methyl-Hexanoic Acid Ethyl Ester
• Molecular Formula: C₁₆H₂₂O₃
• Molecular Weight: 262.35
• CAS Registry Number: 6305-62-0
• SMILES: C1=CC=CC=C1C(C(CCC(C)C)C(OCC)=O)=O
• InChI: 1S/C16H22O3/c1-4-19-16(18)14(11-10-12(2)3)15(17)13-8-6-5-7-9-13/h5-9,12,14H,4,10-11H2,1-3H3
• InChIKey: NEGHEQTZPWCFSR-UHFFFAOYSA-N

Properties

• Density: 1.02g/cm³ (Cal.)
• Boiling point: 340.03°C at 760 mmHg (Cal.)
• Flash point: 145.074°C (Cal.)