4',5',7-Tribromo-3',6'-Dihydroxy-3-Oxo-Spiro[Isobenzofuran-1,9'-Xanthene]-2',7'-Dicarboxylic Acid
[CAS# 33014-42-5]

Identification

• Name: 4',5',7-Tribromo-3',6'-Dihydroxy-3-Oxo-Spiro[Isobenzofuran-1,9'-Xanthene]-2',7'-Dicarboxylic Acid
• Molecular Formula: C₂₂H₉Br₃O₉
• Molecular Weight: 657.01
• CAS Registry Number: 33014-42-5
• SMILES: c1cc2c(c(c1)Br)C3(c4cc(c(c(c4Oc5c3cc(c(c5Br)O)C(=O)O)Br)O)C(=O)O)OC2=O
• InChI: 1S/C22H9Br3O9/c23-11-3-1-2-6-12(11)22(34-21(6)32)9-4-7(19(28)29)15(26)13(24)17(9)33-18-10(22)5-8(20(30)31)16(27)14(18)25/h1-5,26-27H,(H,28,29)(H,30,31)
• InChIKey: HVZVCLKSZXSEGI-UHFFFAOYSA-N

Properties

• Density: 2.478g/cm³ (Cal.)
• Boiling point: 798.539°C at 760 mmHg (Cal.)
• Flash point: 436.741°C (Cal.)