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Substance Name: Acetic acid, 2-hydroxy-, compd. with 4,4'-(1,3-phenylenebis(2,1-diazenediyl))bis(1,3-benzenediamine) acetate formate (1:?:?:?)
RN: 68083-37-4
InChIKey: NFLGGRPVAPABQW-COWOPEBESA-N

Molecular Formula

  • C18-H18-N8.x-C2-H4-O3.x-C2-H4-O2.x-C-H2-O2

Molecular Weight

  • 528.523
 
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Names and Synonyms

Synonyms

  • EINECS 268-386-5
  • m-Phenylenediamine, 4,4'-(m-phenylenebis(azo))bis-, acetate, formate, glycolate

Systematic Names

  • Acetic acid, 2-hydroxy-, compd. with 4,4'-(1,3-phenylenebis(2,1-diazenediyl))bis(1,3-benzenediamine) acetate formate (1:?:?:?)
  • Acetic acid, hydroxy-, compd. with 4,4'-(1,3-phenylenebis(azo))bis(1,3-benzenediamine) acetate formate
  • Hydroxyacetic acid, compound with 4,4'-(m-phenylenebis(azo))bis(benzene-1,3-diamine) acetate formate

Registry Numbers

CAS Registry Number

  • 68083-37-4

System Generated Number

  • 0068083374

Molecular Formulas

Molecular Formula

  • C18-H18-N8.x-C2-H4-O3.x-C2-H4-O2.x-C-H2-O2

Molecular Formula Fragments

  • C-H2-O2
  • C18-H18-N8
  • C2-H4-O2
  • C2-H4-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C18H18N8.C2H4O3.C2H4O2.CH2O2/c19-11-4-6-17(15(21)8-11)25-23-13-2-1-3-14(10-13)24-26-18-7-5-12(20)9-16(18)22;3-1-2(4)5;1-2(3)4;2-1-3/h1-10H,19-22H2;3H,1H2,(H,4,5);1H3,(H,3,4);1H,(H,2,3)/b25-23+,26-24+;;;

InChIKey

NFLGGRPVAPABQW-COWOPEBESA-N

Smiles

Nc1ccc(c(c1)N)\N=N\c1cc(\N=N\c2c(N)cc(N)cc2)ccc1.C(C(O)=O)O.CC(O)=O.C(O)=O