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Substance Name: Hydrogen hydroxy(2-hydroxy-3-((2-hydroxy-4-nitrobenzylidene)amino)-5-nitrobenzenesulphonato(3-))chromate(1-), compound with 3-((2-ethylhexyl)oxy)propylamine (1:1)
RN: 85455-34-1
InChIKey: ROOANLXQLHOJKB-DHDLBUMISA-K

Molecular Formula

  • C13-H7-Cr-N3-O10-S.C11-H25-N-O.H

Molecular Weight

  • 637.6037
 
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Names and Synonyms

Synonym

  • EINECS 287-268-4

Systematic Name

  • Hydrogen hydroxy(2-hydroxy-3-((2-hydroxy-4-nitrobenzylidene)amino)-5-nitrobenzenesulphonato(3-))chromate(1-), compound with 3-((2-ethylhexyl)oxy)propylamine (1:1)

Registry Numbers

CAS Registry Number

  • 85455-34-1

System Generated Number

  • 0085455341

Molecular Formulas

Molecular Formula

  • C13-H7-Cr-N3-O10-S.C11-H25-N-O.H

Molecular Formula Fragments

  • C11-H25-N-O
  • C13-H7-Cr-N3-O10-S
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C13H9N3O9S.C11H25NO.Cr.H2O/c17-11-4-8(15(19)20)2-1-7(11)6-14-10-3-9(16(21)22)5-12(13(10)18)26(23,24)25;1-3-5-7-11(4-2)10-13-9-6-8-12;;/h1-6,17-18H,(H,23,24,25);11H,3-10,12H2,1-2H3;;1H2/q;;+3;/p-3/b14-6+;;;

InChIKey

ROOANLXQLHOJKB-DHDLBUMISA-K

Smiles

CCCCC(CC)COCCCN.O[Cr-]12Oc3cc(ccc3\C=N\c4cc(cc(c4O1)S(=O)(=O)O2)[N+](=O)[O-])[N+](=O)[O-]