4-(2-Methoxy-5-Methyl-Phenyl)-4-Oxo-Butyric Acid
[CAS# 55007-22-2]

Identification

• Name: 4-(2-Methoxy-5-Methyl-Phenyl)-4-Oxo-Butyric Acid
• Synonyms: 4-(2-Methoxy-5-Methyl-Phenyl)-4-Oxo-Butanoate; 4-Keto-4-(2-Methoxy-5-Methyl-Phenyl)Butyrate; Zinc00327634
• Molecular Formula: C₁₂H₁₃O₄
• Molecular Weight: 221.23
• CAS Registry Number: 55007-22-2
• SMILES: C1=C(C=CC(=C1C(=O)CCC([O-])=O)OC)C
• InChI: 1S/C12H14O4/c1-8-3-5-11(16-2)9(7-8)10(13)4-6-12(14)15/h3,5,7H,4,6H2,1-2H3,(H,14,15)/p-1
• InChIKey: DAVYMGMWMJJLHA-UHFFFAOYSA-M

Properties

• Boiling point: 412.375°C at 760 mmHg (Cal.)
• Flash point: 160.287°C (Cal.)