(E)-4-(3-Acetyl-4,5,7,10-Tetrahydroxyanthracen-2-Yl)-3-Hydroxybut-3-Enoic Acid
[CAS# 150547-38-9]

Identification

• Name: (E)-4-(3-Acetyl-4,5,7,10-Tetrahydroxyanthracen-2-Yl)-3-Hydroxybut-3-Enoic Acid
• Synonyms: (E)-4-(3-Acetyl-4,5,7,10-Tetrahydroxy-2-Anthryl)-3-Hydroxy-But-3-Enoic Acid; (E)-4-(3-Acetyl-4,5,7,10-Tetrahydroxy-2-Anthryl)-3-Hydroxybut-3-Enoic Acid; (E)-4-(3-Ethanoyl-4,5,7,10-Tetrahydroxy-Anthracen-2-Yl)-3-Hydroxy-But-3-Enoic Acid
• Molecular Formula: C₂₀H₁₆O₈
• Molecular Weight: 384.34
• CAS Registry Number: 150547-38-9
• SMILES: C1=C3C(=C(O)C2=C1C=C(C(=C2O)C(=O)C)\C=C(O)/CC(=O)O)C(=CC(=C3)O)O
• InChI: 1S/C20H16O8/c1-8(21)16-10(4-13(23)7-15(25)26)2-9-3-11-5-12(22)6-14(24)17(11)20(28)18(9)19(16)27/h2-6,22-24,27-28H,7H2,1H3,(H,25,26)/b13-4+
• InChIKey: DHOSUPJHLBTMAV-YIXHJXPBSA-N

Properties

• Density: 1.654g/cm³ (Cal.)
• Boiling point: 733.521°C at 760 mmHg (Cal.)
• Flash point: 411.358°C (Cal.)