Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Chromate(3-), bis(2-(hydroxy-kappaO)-5-nitro-3-(2-(2-(oxo-kappaO)-1-((phenylamino)carbonyl)propyl)diazenyl-kappaN1)benzenesulfonato(3-))-, compd. with 3-((2-ethylhexyl)oxy)-1-propanamine
RN: 84961-85-3
InChIKey: JXTAEMHCGDMRJZ-HFJGHOORSA-M

Classification Code

  • TSCA UVCB

Molecular Formula

  • C32-H22-Cr-N8-O16-S2.C11-H25-N-O.3H

Molecular Weight

  • 1081.04
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • Compound
  • EINECS 284-676-4

Systematic Names

  • Chromate(3-), bis(2-(hydroxy-kappaO)-5-nitro-3-(2-(2-(oxo-kappaO)-1-((phenylamino)carbonyl)propyl)diazenyl-kappaN1)benzenesulfonato(3-))-, compd. with 3-((2-ethylhexyl)oxy)-1-propanamine
  • Chromate(3-), bis(2-hydroxy-5-nitro-3-((2-oxo-1-((phenylamina)carbonyl)propyl)azo)benzenesulfonato(3-)) -, compd. with 3-((2-ethylhexyl)oxy)-1-propanamine
  • Chromate(3-), bis(2-hydroxy-5-nitro-3-((2-oxo-1-((phenylamino)carbonyl)propyl)azo)benzenesulfonato(3-)) -, compd. with 3-((2-ethylhexyl)oxy)-1-propanamine

Registry Numbers

CAS Registry Number

  • 84961-85-3

System Generated Number

  • 0084961853

Molecular Formulas

Molecular Formula

  • C32-H22-Cr-N8-O16-S2.C11-H25-N-O.3H

Molecular Formula Fragments

  • C11-H25-N-O
  • C32-H22-Cr-N8-O16-S2
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/2C16H13N4O8S.C11H25NO.Cr/c2*1-9(21)14(16(23)17-10-5-3-2-4-6-10)19-18-12-7-11(20(24)25)8-13(15(12)22)29(26,27)28;1-3-5-7-11(4-2)10-13-9-6-8-12;/h2*2-8,22H,1H3,(H,17,23)(H,26,27,28);11H,3-10,12H2,1-2H3;/q2*-1;;+3/p-1/b2*19-18+;;

InChIKey

JXTAEMHCGDMRJZ-HFJGHOORSA-M

Smiles

c1(NC([C@@-](C(=O)C)\N=N\c2cc(cc(S([O-])(=O)=O)c2[O-])[N+]([O-])=O)=O)ccccc1.[Cr+3].c1(ccccc1)NC([C@@-](C(C)=O)\N=N\c1cc([N+]([O-])=O)cc(c1[O-])S([O-])(=O)=O)=O.C(CCOC[C@@H](CCCC)CC)N