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CHEBI:63827 - bromosulfophthalein sodium

ChEBI IDCHEBI:63827
ChEBI Namebromosulfophthalein sodium
Stars
DefinitionAn organic sodium salt that is the disodium salt of bromosulfophthalein.
Last Modified19 March 2018
SubmitterSteve
DownloadsMolfile
FormulaC20H8Br4O10S2.2Na
Net Charge0
Average Mass838.004
Monoisotopic Mass833.60878
SMILESO=C1OC(c2ccc(O)c(S(=O)(=O)[O-])c2)(c2ccc(O)c(S(=O)(=O)[O-])c2)c2c(Br)c(Br)c(Br)c(Br)c21.[Na+].[Na+]
InChIInChI=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
InChIKeyGHAFORRTMVIXHS-UHFFFAOYSA-L
Roles Classification
Application:
dye 
ChEBI Ontology
Outgoing Relation(s)
bromosulfophthalein sodium (CHEBI:63827) has functional parent 2-benzofuran-1(3H)-one (CHEBI:38085)
bromosulfophthalein sodium (CHEBI:63827) has part bromosulfophthalein(2−) (CHEBI:63832)
bromosulfophthalein sodium (CHEBI:63827) has role dye (CHEBI:37958)
bromosulfophthalein sodium (CHEBI:63827) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
disodium 3,3'-(4,5,6,7-tetrabromo-3-oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(6-hydroxybenzenesulfonate)
Synonyms  Source
bromosulfophthalein disodium saltChEBI
Sodium phenol tetrabromophthaleinChemIDplus
Sulphobromophthalein sodiumChemIDplus
TetrabromophenolsulfophthaleinChemIDplus
BromosulphthaleinChemIDplus
Disodium bromosulfophthaleinChemIDplus
Registry NumbersSources
Reaxys:7110446Reaxys
CAS:71-67-0ChemIDplus
Citations