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Substance Name: Benzoic acid, 3,3'-methylenebis(6-(2-(2,4-dihydroxyphenyl)diazenyl)-, sodium salt (1:2)
RN: 63589-40-2
InChIKey: UHFYTHIVRBDXEE-DBHLKOEUSA-L

Molecular Formula

  • C27-H20-N4-O8.2Na

Molecular Weight

  • 572.439
 
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Names and Synonyms

Synonym

  • Benzoic acid, 3,3'-methylenebis(6-((2,4-dihydroxyphenyl)azo)-, disodium salt

Systematic Names

  • Benzoic acid, 3,3'-methylenebis(6-((2,4-dihydroxyphenyl)azo)-, disodium salt
  • Benzoic acid, 3,3'-methylenebis(6-(2-(2,4-dihydroxyphenyl)diazenyl)-, sodium salt (1:2)

Registry Numbers

CAS Registry Number

  • 63589-40-2

System Generated Number

  • 0063589402

Molecular Formulas

Molecular Formula

  • C27-H20-N4-O8.2Na

Molecular Formula Fragments

  • C27-H20-N4-O8
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C27H20N4O8.2Na/c32-16-3-7-22(24(34)12-16)30-28-20-5-1-14(10-18(20)26(36)37)9-15-2-6-21(19(11-15)27(38)39)29-31-23-8-4-17(33)13-25(23)35;;/h1-8,10-13,32-35H,9H2,(H,36,37)(H,38,39);;/q;2*+1/p-2/b30-28+,31-29+;;

InChIKey

UHFYTHIVRBDXEE-DBHLKOEUSA-L

Smiles

Oc1cc(O)c(\N=N\c2c(C(=O)[O-])cc(Cc3cc(C(=O)[O-])c(\N=N\c4c(O)cc(O)cc4)cc3)cc2)cc1.[Na+].[Na+]