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Substance Name: Sodium o-(bis(3,5-dibromo-4-hydroxy-o-tolyl)hydroxymethyl)benzenesulphonate
RN: 23778-59-8
InChIKey: JZPSZYZAQKDLMK-UHFFFAOYSA-M

Molecular Formula

  • C21-H16-Br4-O6-S.Na

Molecular Weight

  • 738.016
 
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Names and Synonyms

Synonym

  • EINECS 245-875-1

Systematic Name

  • Sodium o-(bis(3,5-dibromo-4-hydroxy-o-tolyl)hydroxymethyl)benzenesulphonate

Registry Numbers

CAS Registry Number

  • 23778-59-8

System Generated Number

  • 0023778598

Molecular Formulas

Molecular Formula

  • C21-H16-Br4-O6-S.Na

Molecular Formula Fragments

  • C21-H16-Br4-O6-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H16Br4O6S.Na/c1-9-12(7-14(22)19(26)17(9)24)21(28,11-5-3-4-6-16(11)32(29,30)31)13-8-15(23)20(27)18(25)10(13)2;/h3-8,26-28H,1-2H3,(H,29,30,31);/q;+1/p-1

InChIKey

JZPSZYZAQKDLMK-UHFFFAOYSA-M

Smiles

c1(C(c2c(c(Br)c(c(c2)Br)O)C)(O)c2c(S(=O)([O-])=O)cccc2)c(C)c(c(c(c1)Br)O)Br.[Na+]