4-(5-Fluoro-2-methylphenyl)-4-oxobutanoic acid
[CAS# 97072-94-1]

Identification

• Name: 4-(5-Fluoro-2-methylphenyl)-4-oxobutanoic acid
• Synonyms: 4-(2-Methyl-5-fluorophenyl)-4-oxobutyric acid
• Molecular Formula: C₁₁H₁₁FO₃
• Molecular Weight: 210.20
• CAS Registry Number: 97072-94-1
• SMILES: Cc1ccc(F)cc1C(=O)CCC(O)=O
• InChI: 1S/C11H11FO3/c1-7-2-3-8(12)6-9(7)10(13)4-5-11(14)15/h2-3,6H,4-5H2,1H3,(H,14,15)
• InChIKey: TYPYYKDDDSORJQ-UHFFFAOYSA-N

Properties

• Density: 1.243g/cm³ (Cal.)
• Boiling point: 378.027°C at 760 mmHg (Cal.)
• Flash point: 182.425°C (Cal.)