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Substance Name: Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis(2,6-dibromo-3-methyl-, sodium salt (1:2)
RN: 71138-75-5
InChIKey: NNFIMRRERYDINV-UHFFFAOYSA-N

Molecular Formula

  • C21-H14-Br4-O5-S.2Na

Molecular Weight

  • 743.9986
 
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Names and Synonyms

  • Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis(2,6-dibromo-3-methyl-, disodium salt
  • Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis(2,6-dibromo-3-methyl-, sodium salt (1:2)

Registry Numbers

CAS Registry Number

  • 71138-75-5

System Generated Number

  • 0071138755

Molecular Formulas

Molecular Formula

  • C21-H14-Br4-O5-S.2Na

Molecular Formula Fragments

  • C21-H14-Br4-O5-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H14Br4O5S.2Na/c1-9-12(7-14(22)19(26)17(9)24)21(13-8-15(23)20(27)18(25)10(13)2)11-5-3-4-6-16(11)31(28,29)30-21;;/h3-8,26-27H,1-2H3;;/q;2*+1

InChIKey

NNFIMRRERYDINV-UHFFFAOYSA-N

Smiles

Cc1c(cc(c(c1Br)O)Br)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4C)Br)O)Br.[Na+].[Na+]