4-(4-Bromo-2-methylphenyl)-4-oxobutanoic acid
[CAS# 898767-28-7]

Identification

• Name: 4-(4-Bromo-2-methylphenyl)-4-oxobutanoic acid
• Synonyms: 4-(4-bromo-2-methylphenyl)-4-oxobutanoic acid; 4-(4-Bromo-2-methylphenyl)-4-oxobutyric acid
• Molecular Formula: C₁₁H₁₁BrO₃
• Molecular Weight: 271.11
• CAS Registry Number: 898767-28-7
• SMILES: O=C(CCC(O)=O)c1ccc(Br)cc1C
• InChI: 1S/C11H11BrO3/c1-7-6-8(12)2-3-9(7)10(13)4-5-11(14)15/h2-3,6H,4-5H2,1H3,(H,14,15)
• InChIKey: QBAFDTBWFLFGDS-UHFFFAOYSA-N

Properties

• Density: 1.497g/cm³ (Cal.)
• Boiling point: 437.115°C at 760 mmHg (Cal.)
• Flash point: 218.16°C (Cal.)
• Refractive index: 1.572 (Cal.)