2-Propylvaleric acid (2-keto-2-phenyl-ethyl) ester
[CAS# 71683-26-6]

Identification

• Name: 2-Propylvaleric acid (2-keto-2-phenyl-ethyl) ester
• Synonyms: (2-Oxo-2-Phenyl-Ethyl) 2-Propylpentanoate; 2-Propylpentanoic Acid (2-Oxo-2-Phenylethyl) Ester; 2-Propylvaleric Acid (2-Keto-2-Phenyl-Ethyl) Ester
• Molecular Formula: C₁₆H₂₂O₃
• Molecular Weight: 262.35
• CAS Registry Number: 71683-26-6
• SMILES: C1=CC=CC=C1C(=O)COC(=O)C(CCC)CCC
• InChI: 1S/C16H22O3/c1-3-8-14(9-4-2)16(18)19-12-15(17)13-10-6-5-7-11-13/h5-7,10-11,14H,3-4,8-9,12H2,1-2H3
• InChIKey: AYODBLPOZVDJEL-UHFFFAOYSA-N

Properties

• Density: 1.021g/cm³ (Cal.)
• Boiling point: 359.376°C at 760 mmHg (Cal.)
• Flash point: 154.998°C (Cal.)