5-Bromo-4-Oxo-2-Phenylhexanoic Acid
[CAS# 81214-88-2]

Identification

• Name: 5-Bromo-4-Oxo-2-Phenylhexanoic Acid
• Synonyms: 5-Bromo-4-Oxo-2-Phenyl-Hexanoic Acid; 5-Bromo-4-Keto-2-Phenyl-Hexanoic Acid; 5-Boph
• Molecular Formula: C₁₂H₁₃BrO₃
• Molecular Weight: 285.14
• CAS Registry Number: 81214-88-2
• SMILES: C1=CC=CC=C1C(C(=O)O)CC(C(C)Br)=O
• InChI: 1S/C12H13BrO3/c1-8(13)11(14)7-10(12(15)16)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,15,16)
• InChIKey: DNDCKTJRGLMEAR-UHFFFAOYSA-N

Properties

• Density: 1.467g/cm³ (Cal.)
• Boiling point: 393.734°C at 760 mmHg (Cal.)
• Flash point: 191.924°C (Cal.)