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3,3'-(4,5,6,7-Tetrabromo-3-Oxo-1(3H)-Isobenzofuranylidene)Bis[6-Hydroxy-Benzenesulfonic Acid] Disodium Salt
[CAS# 71-67-0]

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Identification
Name 3,3'-(4,5,6,7-Tetrabromo-3-Oxo-1(3H)-Isobenzofuranylidene)Bis[6-Hydroxy-Benzenesulfonic Acid] Disodium Salt
Synonyms Disodium 2-Hydroxy-5-[4,5,6,7-Tetrabromo-1-(4-Hydroxy-3-Sulfonato-Phenyl)-3-Oxo-Isobenzofuran-1-Yl]Benzenesulfonate; Disodium 2-Hydroxy-5-[4,5,6,7-Tetrabromo-1-(4-Hydroxy-3-Sulfonatophenyl)-3-Oxo-1-Isobenzofuranyl]Benzenesulfonate; Disodium 2-Hydroxy-5-[4,5,6,7-Tetrabromo-1-(4-Hydroxy-3-Sulfonato-Phenyl)-3-Keto-Isobenzofuran-1-Yl]Benzenesulfonate
Molecular Structure CAS#: 71-67-0, 3,3'-(4,5,6,7-Tetrabromo-3-Oxo-1(3H)-Isobenzofuranylidene)Bis[6-Hydroxy-Benzenesulfonic Acid] Disodium Salt
Molecular Formula C20H8Br4Na2O10S2
Molecular Weight 837.99
CAS Registry Number 71-67-0
EINECS 200-761-0
SMILES C4=C(C2(C1=CC=C(C(=C1)[S]([O-])(=O)=O)O)C3=C(C(O2)=O)C(=C(C(=C3Br)Br)Br)Br)C=CC(=C4[S]([O-])(=O)=O)O.[Na+].[Na+]
InChI 1S/C20H10Br4O10S2.2Na/c21-15-13-14(16(22)18(24)17(15)23)20(34-19(13)27,7-1-3-9(25)11(5-7)35(28,29)30)8-2-4-10(26)12(6-8)36(31,32)33;;/h1-6,25-26H,(H,28,29,30)(H,31,32,33);;/q;2*+1/p-2
InChIKey GHAFORRTMVIXHS-UHFFFAOYSA-L
Safety Data
Safety Description Safety glasses.
SDS Available
References
(1) Simon Coleman, Robert Byrne, Nameer Alhashimy, Kevin J. Fraser, Douglas R. MacFarlane and Dermot Diamond. Photochromic imidazolium based ionic liquids based on spiropyran, Phys. Chem. Chem. Phys., 2010, 12, 7009.
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