Clofibric Furanoglucuronate
[CAS# 80106-54-3]

Identification

• Name: Clofibric Furanoglucuronate
• Synonyms: (2S)-2-[(2S,3R,4R)-5-[2-(4-Chlorophenoxy)-2-Methyl-Propanoyl]Oxy-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]-2-Hydroxy-Acetic Acid; (2S)-2-[(2S,3R,4R)-5-[2-(4-Chlorophenoxy)-2-Methyl-1-Oxopropoxy]-3,4-Dihydroxy-2-Tetrahydrofuranyl]-2-Hydroxyacetic Acid; (2S)-2-[(2S,3R,4R)-5-[2-(4-Chlorophenoxy)-2-Methyl-Propanoyl]Oxy-3,4-Dihydroxy-Oxolan-2-Yl]-2-Hydroxy-Ethanoic Acid
• Molecular Formula: C₁₆H₁₉ClO₉
• Molecular Weight: 390.77
• CAS Registry Number: 80106-54-3
• SMILES: [C@@H]1(C(O[C@@H]([C@@H]1O)[C@H](O)C(=O)O)OC(C(C)(C)OC2=CC=C(C=C2)Cl)=O)O
• InChI: 1S/C16H19ClO9/c1-16(2,26-8-5-3-7(17)4-6-8)15(23)25-14-10(19)9(18)12(24-14)11(20)13(21)22/h3-6,9-12,14,18-20H,1-2H3,(H,21,22)/t9-,10-,11+,12+,14?/m1/s1
• InChIKey: SQRMJHLEXPNYKB-MKURHVDASA-N

Properties

• Density: 1.553g/cm³ (Cal.)
• Boiling point: 611.255°C at 760 mmHg (Cal.)
• Flash point: 323.475°C (Cal.)