4-Bromo-5-Oxo-5-Phenylpentanoic Acid
[CAS# 39826-14-7]

Identification

• Name: 4-Bromo-5-Oxo-5-Phenylpentanoic Acid
• Synonyms: 4-Bromo-5-Oxo-5-Phenyl-Pentanoic Acid; 4-Bromo-5-Keto-5-Phenyl-Valeric Acid; 4-Bromo-4-Benzoylbutyric Acid
• Molecular Formula: C₁₁H₁₁BrO₃
• Molecular Weight: 271.11
• CAS Registry Number: 39826-14-7
• SMILES: C1=CC=CC=C1C(C(Br)CCC(=O)O)=O
• InChI: 1S/C11H11BrO3/c12-9(6-7-10(13)14)11(15)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,14)
• InChIKey: VSRWEJNGQWEPPH-UHFFFAOYSA-N

Properties

• Density: 1.517g/cm³ (Cal.)
• Boiling point: 405.968°C at 760 mmHg (Cal.)
• Flash point: 199.323°C (Cal.)