4-(2,3-Dimethoxyphenyl)-4-oxobutanoic acid
[CAS# 898792-27-3]

Identification

• Name: 4-(2,3-Dimethoxyphenyl)-4-oxobutanoic acid
• Synonyms: 4-(2,3-Dimethoxyphenyl)-4-oxobutyric acid
• Molecular Formula: C₁₂H₁₄O₅
• Molecular Weight: 238.24
• CAS Registry Number: 898792-27-3
• SMILES: COc1cccc(c1OC)C(=O)CCC(O)=O
• InChI: 1S/C12H14O5/c1-16-10-5-3-4-8(12(10)17-2)9(13)6-7-11(14)15/h3-5H,6-7H2,1-2H3,(H,14,15)
• InChIKey: QUWHEXSRYUEKHA-UHFFFAOYSA-N

Properties

• Density: 1.212g/cm³ (Cal.)
• Boiling point: 406.832°C at 760 mmHg (Cal.)
• Flash point: 156.194°C (Cal.)
• Refractive index: 1.527 (Cal.)