4-(3-Bromo-5-methylphenyl)-4-oxobutanoic acid
[CAS# 898767-43-6]

Identification

• Name: 4-(3-Bromo-5-methylphenyl)-4-oxobutanoic acid
• Synonyms: 4-(3-Bromo-5-methylphenyl)-4-oxobutyric acid
• Molecular Formula: C₁₁H₁₁BrO₃
• Molecular Weight: 271.11
• CAS Registry Number: 898767-43-6
• SMILES: Cc1cc(cc(Br)c1)C(=O)CCC(O)=O
• InChI: 1S/C11H11BrO3/c1-7-4-8(6-9(12)5-7)10(13)2-3-11(14)15/h4-6H,2-3H2,1H3,(H,14,15)
• InChIKey: GPYLJYZHZGVNGV-UHFFFAOYSA-N

Properties

• Density: 1.497g/cm³ (Cal.)
• Boiling point: 439.867°C at 760 mmHg (Cal.)
• Flash point: 219.824°C (Cal.)
• Refractive index: 1.572 (Cal.)