3-Oxo-2-Butanyl 3,4,5-Trihydroxybenzoate
[CAS# 26818-10-0]

Identification

• Name: 3-Oxo-2-Butanyl 3,4,5-Trihydroxybenzoate
• Synonyms: 1-Methyl-2-oxopropyl 3,4,5-trihydroxybenzoate #
• Molecular Formula: C₁₁H₁₂O₆
• Molecular Weight: 240.21
• CAS Registry Number: 26818-10-0
• SMILES: O=C(C)C(OC(=O)c1cc(O)c(O)c(O)c1)C
• InChI: 1S/C11H12O6/c1-5(12)6(2)17-11(16)7-3-8(13)10(15)9(14)4-7/h3-4,6,13-15H,1-2H3
• InChIKey: QGHKLYWATOLWIR-UHFFFAOYSA-N

Properties

• Density: 1.416g/cm³ (Cal.)
• Boiling point: 506.72°C at 760 mmHg (Cal.)
• Flash point: 201.454°C (Cal.)
• Refractive index: 1.594 (Cal.)