4',5'-Dibromo-3',6'-Dihydroxy-2',7'-Diiodo-Spiro[Isobenzofuran-3,9'-Xanthene]-1-One
[CAS# 31544-98-6]

Identification

• Name: 4',5'-Dibromo-3',6'-Dihydroxy-2',7'-Diiodo-Spiro[Isobenzofuran-3,9'-Xanthene]-1-One
• Molecular Formula: C₂₀H₈Br₂I₂O₅
• Molecular Weight: 741.89
• CAS Registry Number: 31544-98-6
• SMILES: c1ccc2c(c1)C(=O)OC23c4cc(c(c(c4Oc5c3cc(c(c5Br)O)I)Br)O)I
• InChI: 1S/C20H8Br2I2O5/c21-13-15(25)11(23)5-9-17(13)28-18-10(6-12(24)16(26)14(18)22)20(9)8-4-2-1-3-7(8)19(27)29-20/h1-6,25-26H
• InChIKey: UJAMHKILNDLQTJ-UHFFFAOYSA-N

Properties

• Density: 2.732g/cm³ (Cal.)
• Boiling point: 628.08°C at 760 mmHg (Cal.)
• Flash point: 333.651°C (Cal.)