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Substance Name: EINECS 229-400-5
RN: 6508-68-5
InChIKey: FTLCGVVRFDRTGD-RTDABLOBSA-H

Molecular Formula

  • C40-H24-N8-O18-S6.6Na

Molecular Weight

  • 1228.9562
 
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Names and Synonyms

Results Name

  • EINECS 229-400-5

Synonym

  • EINECS 229-400-5

Systematic Name

  • Hexasodium 3,3'-azobis(7-(6-sulphonato-2H-naphtho(1,2-d)triazol-2-yl)naphthalene-1,5-disulphonate)

Registry Numbers

CAS Registry Number

  • 6508-68-5

System Generated Number

  • 0006508685

Molecular Formulas

Molecular Formula

  • C40-H24-N8-O18-S6.6Na

Molecular Formula Fragments

  • C40-H24-N8-O18-S6
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C40H24N8O18S6.6Na/c49-67(50,51)33-5-1-3-25-23(33)7-9-31-39(25)45-47(43-31)21-15-29-27(37(17-21)71(61,62)63)11-19(13-35(29)69(55,56)57)41-42-20-12-28-30(36(14-20)70(58,59)60)16-22(18-38(28)72(64,65)66)48-44-32-10-8-24-26(40(32)46-48)4-2-6-34(24)68(52,53)54;;;;;;/h1-18H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66);;;;;;/q;6*+1/p-6/b42-41+;;;;;;

InChIKey

FTLCGVVRFDRTGD-RTDABLOBSA-H

Smiles

c1cc2c(ccc3c2nn(n3)c4cc5c(cc(cc5S(=O)(=O)[O-])/N=N/c6cc7c(cc(cc7S(=O)(=O)[O-])n8nc9ccc2c(c9n8)cccc2S(=O)(=O)[O-])c(c6)S(=O)(=O)[O-])c(c4)S(=O)(=O)[O-])c(c1)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]