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Substance Name: Benzoic acid, 2,2'-((2,4(3,5 or 4,6)-dihydroxyphenylene)bis(2,1-diazenediyl))bis-, 1,1'-bis(2-(dimethylamino)ethyl) ester, hydrochloride (1:2)
RN: 118208-02-9
InChIKey: PDUYOVXMHWNARS-UZKSOGDPSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C28-H32-N6-O6.2Cl-H

Molecular Weight

  • 623.5344
 
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Names and Synonyms

Synonym

  • EC 407-010-8

Systematic Names

  • 2,4-Bis(2,2'-(2-(N,N-dimethylamino)ethyloxycarbonyl)phenylazo)-1,3-dihydroxybenzene-dihydrochloride
  • Benzoic acid, 2,2'-((2,4(3,5 or 4,6)-dihydroxyphenylene)bis(2,1-diazenediyl))bis-, 1,1'-bis(2-(dimethylamino)ethyl) ester, hydrochloride (1:2)
  • Benzoic acid, 2,2'-((2,4(3,5 or 4,6)-dihydroxyphenylene)bis(azo))bis-, bis(2-(dimethylamino)ethyl) ester, dihydrochloride

Registry Numbers

CAS Registry Number

  • 118208-02-9

System Generated Number

  • 0118208029

Molecular Formulas

Molecular Formula

  • C28-H32-N6-O6.2Cl-H

Molecular Formula Fragments

  • C28-H32-N6-O6
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C28H34N6O6.2ClH/c1-33(2)15-17-39-26(36)21-9-5-7-11-23(21)29-31-25-14-13-20(35)19-28(25,38)32-30-24-12-8-6-10-22(24)27(37)40-18-16-34(3)4;;/h5-14,35,38H,15-19H2,1-4H3;2*1H/b31-29+,32-30-;;

InChIKey

PDUYOVXMHWNARS-UZKSOGDPSA-N

Smiles

C1(C(=CC=C(C1)O)/N=N/c1c(C(=O)OCCN(C)C)cccc1)(/N=N\c1c(C(=O)OCCN(C)C)cccc1)O.Cl.Cl