RefChem:117857 structure

RefChem:117857

trisodium;2-hydroxy-5-[1-(4-oxido-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate

Also Known As: EINECS 263-634-9|Benzenesulfonic acid, 3,3'-(3-oxo-1(3H)-isobenzofuranylidene)bis(6-hydroxy-, trisodium salt|trisodium 2-hydroxy-5-[1-(4-oxido-3-sulfonatophenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]benzenesulfonate|Benzenesulfonic acid, 3,3'-(3-oxo-1(3H)-isobenzofuranylidene)bis(6-hydroxy-, sodium salt (1:3)|Benzenesulfonic acid, 3,3'-(3-oxo-1(3H)-isobenzofuranylidene)bis[6-hydroxy-, sodium salt (1:3)|Benzenesulfonic acid, 3,3'-(3-oxo-1(3H)-isobenzofuranylidene)bis[6-hydroxy-, trisodium salt|Trisodium 2-hydroxy-5-[1-(4-oxido-3-sulfonatophenyl)-3-oxo-1,3-di hydro-2-benzofuran-1-yl]benzenesulfonate|Trisodium 2-hydroxy-5-[1-(4-oxido-3-sulfonatophenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]benzene-1-sulfonate|trisodium 2-hydroxy-5-[1-(4-oxido-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate|Trisodium alpha-(4-hydroxy-3-sulfonatophenyl)-alpha-(4-oxo-3-sulfonatocyclohexa-2,5-dienylidene)-alpha-toluate|Trisodium alpha-(4-hydroxy-3-sulphonatophenyl)-alpha-(4-oxo-3-sulphonatocyclohexa-2,5-dienylidene)-alpha-toluate

CAS: 62609-87-4
Molecular Formula C20H11Na3O10S2
Molecular Weight 543.94867 g/mol
LogP -8.25
Topological Polar Surface Area 183.99 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 10
Rotatable Bonds 4
Exact Mass 543.94867
Heavy Atoms 35
Complexity 1423.8

Chemical Identifiers

CAS Number 62609-87-4
SMILES C1=CC=C2C(=C1)C(=O)OC2(C3=CC(=C(C=C3)O)S(=O)(=O)[O-])C4=CC(=C(C=C4)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Product Overview

RefChem:117857 (CAS 62609-87-4), with molecular formula C20H11Na3O10S2 and molecular weight 543.94867 g/mol. IUPAC: trisodium;2-hydroxy-5-[1-(4-oxido-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate.

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