4,4′-Bis[2-[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]diazenyl][1,1′-biphenyl]-2,2′-disulfonic acid

CAS Registry Number®

78952-69-9
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CAS Name

4,4′-Bis[2-[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]diazenyl][1,1′-biphenyl]-2,2′-disulfonic acid

Molecular Formula

C36H36N6O10S2

Molecular Mass

776.84

Cite this Page

4,4′-Bis[2-[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]diazenyl][1,1′-biphenyl]-2,2′-disulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=78952-69-9 (retrieved 2024-09-21) (CAS RN: 78952-69-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H36N6O10S2/c1-19-7-13-29(21(3)15-19)37-35(45)33(23(5)43)41-39-25-9-11-27(31(17-25)53(47,48)49)28-12-10-26(18-32(28)54(50,51)52)40-42-34(24(6)44)36(46)38-30-14-8-20(2)16-22(30)4/h7-18,33-34H,1-6H3,(H,37,45)(H,38,46)(H,47,48,49)(H,50,51,52)

InChIKey

InChIKey=ZVYYAZLGILHNEO-UHFFFAOYSA-N

SMILES

S(=O)(=O)(O)C1=C(C=CC(N=NC(C(NC2=C(C)C=C(C)C=C2)=O)C(C)=O)=C1)C3=C(S(=O)(=O)O)C=C(N=NC(C(NC4=C(C)C=C(C)C=C4)=O)C(C)=O)C=C3

Canonical SMILES

O=C(NC1=CC=C(C=C1C)C)C(N=NC=2C=CC(C3=CC=C(N=NC(C(=O)NC4=CC=C(C=C4C)C)C(=O)C)C=C3S(=O)(=O)O)=C(C2)S(=O)(=O)O)C(=O)C

Other Names for this Substance

  • [1,1′-Biphenyl]-2,2′-disulfonic acid, 4,4′-bis[2-[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-
  • [1,1′-Biphenyl]-2,2′-disulfonic acid, 4,4′-bis[[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]azo]-
  • 4,4′-Bis[2-[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]diazenyl][1,1′-biphenyl]-2,2′-disulfonic acid