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Substance Name: Benzoic acid, 2-(hydroxybis(4-(sulfooxy)phenyl)methyl)-, potassium salt (1:3)
RN: 62625-16-5
InChIKey: PLHSVCWOEHYSHO-UHFFFAOYSA-K

Molecular Formula

  • C20-H16-O11-S2.3K

Molecular Weight

  • 610.738
 
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Names and Synonyms

Synonym

  • EINECS 263-648-5

Systematic Names

  • Benzoic acid, 2-(hydroxybis(4-(sulfooxy)phenyl)methyl)-, potassium salt (1:3)
  • Benzoic acid, 2-(hydroxybis(4-(sulfooxy)phenyl)methyl)-, tripotassium salt
  • Tripotassium 2-(hydroxybis(4-(sulphonatooxy)phenyl)methyl)benzoate

Registry Numbers

CAS Registry Number

  • 62625-16-5

Other Registry Number

  • 73008-35-2

System Generated Number

  • 0062625165

Molecular Formulas

Molecular Formula

  • C20-H16-O11-S2.3K

Molecular Formula Fragments

  • C20-H16-O11-S2
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C20H16O11S2.3K/c21-19(22)17-3-1-2-4-18(17)20(23,13-5-9-15(10-6-13)30-32(24,25)26)14-7-11-16(12-8-14)31-33(27,28)29;;;/h1-12,23H,(H,21,22)(H,24,25,26)(H,27,28,29);;;/q;3*+1/p-3

InChIKey

PLHSVCWOEHYSHO-UHFFFAOYSA-K

Smiles

S(=O)(=O)([O-])Oc1ccc(C(O)(c2c(C([O-])=O)cccc2)c2ccc(OS(=O)(=O)[O-])cc2)cc1.[K+].[K+].[K+]