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Dibromsulphalein
[CAS# 17199-35-8]

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CAS#: 17199-35-8
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Identification
Name Dibromsulphalein
Synonyms [4-[4,7-Dibromo-3-Oxo-1-(4-Sulfooxyphenyl)Isobenzofuran-1-Yl]Phenyl] Hydrogen Sulfate; [4-[4,7-Dibromo-3-Oxo-1-(4-Sulfooxyphenyl)-1-Isobenzofuranyl]Phenyl] Hydrogen Sulfate; [4-[4,7-Dibromo-3-Keto-1-(4-Sulfoxyphenyl)Isobenzofuran-1-Yl]Phenyl] Hydrogen Sulfate
Molecular Structure CAS#: 17199-35-8, Dibromsulphalein
Molecular Formula C20H12Br2O10S2
Molecular Weight 636.24
CAS Registry Number 17199-35-8
SMILES C1=CC(=CC=C1C2(C3=C(C(O2)=O)C(=CC=C3Br)Br)C4=CC=C(O[S](=O)(=O)O)C=C4)O[S](=O)(=O)O
InChI 1S/C20H12Br2O10S2/c21-15-9-10-16(22)18-17(15)19(23)30-20(18,11-1-5-13(6-2-11)31-33(24,25)26)12-3-7-14(8-4-12)32-34(27,28)29/h1-10H,(H,24,25,26)(H,27,28,29)
InChIKey AANIYWVYGNJWIU-UHFFFAOYSA-N
Properties
Density 2.005g/cm3 (Cal.)
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