2-(3-Hydroxy-4,5-diiodo-6-oxo-9-xanthenyl)benzoic acid
[CAS# 518-40-1]

Identification

• Name: 2-(3-Hydroxy-4,5-diiodo-6-oxo-9-xanthenyl)benzoic acid
• Synonyms: 2-(3-Hydroxy-4,5-Diiodo-6-Oxo-Xanthen-9-Yl)Benzoic Acid; 2-(3-Hydroxy-4,5-Diiodo-6-Oxo-9-Xanthenyl)Benzoic Acid; 2-(3-Hydroxy-4,5-Diiodo-6-Keto-Xanthen-9-Yl)Benzoic Acid
• Molecular Formula: C₂₀H₁₀I₂O₅
• Molecular Weight: 584.11
• CAS Registry Number: 518-40-1
• SMILES: C1=CC(=C(C3=C1C(=C2C(=C(C(=O)C=C2)I)O3)C4=CC=CC=C4C(=O)O)I)O
• InChI: 1S/C20H10I2O5/c21-16-13(23)7-5-11-15(9-3-1-2-4-10(9)20(25)26)12-6-8-14(24)17(22)19(12)27-18(11)16/h1-8,23H,(H,25,26)
• InChIKey: ZSRQKMRGZAXRSM-UHFFFAOYSA-N

Properties

• Density: 2.287g/cm³ (Cal.)
• Boiling point: 665.775°C at 760 mmHg (Cal.)
• Flash point: 356.448°C (Cal.)