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Substance Name: C.I. 20460
RN: 5850-35-1
InChIKey: QCWPZYSLMIXIHM-DROYEMJCSA-L

Molecular Formula

  • C22-H16-N6-O9-S2.2Na

Molecular Weight

  • 616.498
 
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Names and Synonyms

Results Name

  • C.I. 20460

Synonyms

  • Acid Blue 29
  • EINECS 227-449-7
  • Mordant Blue 82

Systematic Names

  • 2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-((3-nitrophenyl)azo)-6-(phenylazo)-, disodium salt
  • 2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-(2-(3-nitrophenyl)diazenyl)-6-(2-phenyldiazenyl)-, sodium salt (1:2)
  • Disodium 4-amino-5-hydroxy-3-((3-nitrophenyl)azo)-6-(phenylazo)naphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 5850-35-1

System Generated Number

  • 0005850351

Molecular Formulas

Molecular Formula

  • C22-H16-N6-O9-S2.2Na

Molecular Formula Fragments

  • C22-H16-N6-O9-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C22H16N6O9S2.2Na/c23-19-18-12(10-17(39(35,36)37)21(22(18)29)27-24-13-5-2-1-3-6-13)9-16(38(32,33)34)20(19)26-25-14-7-4-8-15(11-14)28(30)31;;/h1-11,29H,23H2,(H,32,33,34)(H,35,36,37);;/q;2*+1/p-2/b26-25+,27-24+;;

InChIKey

QCWPZYSLMIXIHM-DROYEMJCSA-L

Smiles

c12c(N)c(\N=N\c3cc([N+]([O-])=O)ccc3)c(S(=O)(=O)[O-])cc1cc(S(=O)(=O)[O-])c(\N=N\c1ccccc1)c2O.[Na+].[Na+]