disodium2-hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate
disodium;2-hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate
| Molecular Formula | C20H8Br4Na2O10S2 |
|---|---|
| Molecular Weight | 838.0 g/mol |
| Topological Polar Surface Area | 198.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 837.6047 |
| Heavy Atoms | 38 |
| Complexity | 994.0 |
Chemical Identifiers
| CAS Number | 71-67-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O2)C4=CC(=C(C=C4)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+] |
| InChIKey | GHAFORRTMVIXHS-UHFFFAOYSA-L |
📖 Product Overview
disodium2-hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate (CAS: 71-67-0) is a chemical compound with molecular formula C20H8Br4Na2O10S2 and molecular weight 838.0 g/mol. Its IUPAC systematic name is disodium;2-hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate.
GHAFORRTMVIXHS-UHFFFAOYSA-L.
SMILES: C1=CC(=C(C=C1C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O2)C4=CC(=C(C=C4)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+].
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