2-(2,4,5,7-Tetrabromo-3,6-Dihydroxyxanthen-9-Yl)Benzoic Acid Aluminium Salt
[CAS# 16508-80-8]

Identification

• Name: 2-(2,4,5,7-Tetrabromo-3,6-Dihydroxyxanthen-9-Yl)Benzoic Acid Aluminium Salt
• Synonyms: Aluminum 2',4',5',7'-Tetrabromo-3-Oxo-Spiro[Isobenzofuran-1,9'-Xanthene]-3',6'-Diolate; Aluminum 2',4',5',7'-Tetrabromo-3-Oxospiro[Isobenzofuran-1,9'-Xanthene]-3',6'-Diolate; Aluminum 2',4',5',7'-Tetrabromo-3-Keto-Spiro[Isobenzofuran-1,9'-Xanthene]-3',6'-Diolate
• Molecular Formula: C₂₀H₆AlBr₄O₅
• Molecular Weight: 672.86
• CAS Registry Number: 16508-80-8
• EINECS: 240-569-4
• SMILES: C1=C(Br)C(=C(Br)C4=C1C2(OC(=O)C3=C2C=CC=C3)C5=C(O4)C(=C([O-])C(=C5)Br)Br)[O-].[Al+3]
• InChI: 1S/C20H8Br4O5.Al/c21-11-5-9-17(13(23)15(11)25)28-18-10(6-12(22)16(26)14(18)24)20(9)8-4-2-1-3-7(8)19(27)29-20;/h1-6,25-26H;/q;+3/p-2
• InChIKey: XRFCUEOWYOXQRI-UHFFFAOYSA-L

Properties

• Boiling point: 640.3°C at 760 mmHg (Cal.)
• Flash point: 341°C (Cal.)