Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-((4'-((4-((4-Amino-6(or 7)-sulpho-1-naphthyl)azo)-6(or 7)-sulpho-1-naphthyl)azo)(1,1'-biphenyl)-4-yl)azo)salicylic acid, sodium salt
RN: 85750-37-4
InChIKey: CCSFEKXWWGAPOP-GISMTAOISA-K

Molecular Formula

  • C39-H27-N7-O9-S2.x-Na

Molecular Weight

  • 867.7606
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 288-564-6

Systematic Name

  • 5-((4'-((4-((4-Amino-6(or 7)-sulpho-1-naphthyl)azo)-6(or 7)-sulpho-1-naphthyl)azo)(1,1'-biphenyl)-4-yl)azo)salicylic acid, sodium salt

Registry Numbers

CAS Registry Number

  • 85750-37-4

System Generated Number

  • 0085750374

Molecular Formulas

Molecular Formula

  • C39-H27-N7-O9-S2.x-Na

Molecular Formula Fragments

  • C39-H27-N7-O9-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C39H27N7O9S2.3Na/c40-34-14-15-35(29-12-10-27(20-31(29)34)56(50,51)52)45-46-37-17-16-36(30-13-11-28(21-32(30)37)57(53,54)55)44-42-25-7-3-23(4-8-25)22-1-5-24(6-2-22)41-43-26-9-18-38(47)33(19-26)39(48)49;;;/h1-21,47H,40H2,(H,48,49)(H,50,51,52)(H,53,54,55);;;/q;3*+1/p-3/b43-41+,44-42+,46-45+;;;

InChIKey

CCSFEKXWWGAPOP-GISMTAOISA-K

Smiles

S(=O)(=O)(c1cc2c(c(/N=N/c3ccc(c4ccc(/N=N/c5cc(C(=O)[O-])c(cc5)O)cc4)cc3)ccc2/N=N/c2c3c(cc(S(=O)(=O)[O-])cc3)c(cc2)N)cc1)[O-].[Na+].[Na+].[Na+]