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1',4',5',7,8'-Pentabromo-3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-2',7'-dicarboxylic acid
[CAS# 72994-16-2]

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CAS#: 72994-16-2
Product: 1',4',5',7,8'-Pentabromo-3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-2',7'-dicarboxylic acid
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Identification
Name 1',4',5',7,8'-Pentabromo-3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-2',7'-dicarboxylic acid
Synonyms 9/7/6359
Molecular Structure CAS#: 72994-16-2, 1',4',5',7,8'-Pentabromo-3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-2',7'-dicarboxylic acid
Molecular Formula C22H7Br5O9
Molecular Weight 814.81
CAS Registry Number 72994-16-2
SMILES c1cc2c(c(c1)Br)C3(c4c(c(c(c(c4Br)C(=O)O)O)Br)Oc5c3c(c(c(c5Br)O)C(=O)O)Br)OC2=O
InChI 1S/C22H7Br5O9/c23-5-3-1-2-4-8(5)22(36-21(4)34)9-11(24)6(19(30)31)15(28)13(26)17(9)35-18-10(22)12(25)7(20(32)33)16(29)14(18)27/h1-3,28-29H,(H,30,31)(H,32,33)
InChIKey VFBZCUACIBONPC-UHFFFAOYSA-N
Properties
Density 2.805g/cm3 (Cal.)
Boiling point 822.477°C at 760 mmHg (Cal.)
Flash point 451.218°C (Cal.)
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