AC1Q1JAP structure

AC1Q1JAP

5-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-[4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfophenyl]benzenesulfonic acid

Also Known As: (1,1'-Biphenyl)-2,2'-disulfonic acid, 4,4'-bis((1-(((2,4-dimethylphenyl)amino)carbonyl)-2-oxopropyl)azo)-|(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[[1-[[(2,4-Dimethylphenyl)amino]carbonyl]-2-oxopropyl]azo][1,1'-biphenyl]-2,2'-disulphonic acid|[1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[2-[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-|4,4'-Bis((1-(((2,4-dimethylphenyl)amino)carbonyl)-2-oxopropyl)azo)(1,1'-biphenyl)-2,2'-disulphonic acid|4,4'-bis1-(2,4-Dimethylphenyl)aminocarbonyl-2-oxopropylazo1,1'-biphenyl-2,2'-disulphonic acid|5-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-[4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfophenyl]benzenesulfonic acid|4,4'-bis[[1-[[ amino]carbonyl]-2-oxopropyl]azo][1,1'-biphenyl]-2,2'-disulphonicacid|[1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[[1-[[(2,4-dimethylphenyl) amino]carbonyl]-2-oxopropyl]azo]-|[1,1'-Biphenyl]-2,2'-disulfonicacid,4,4'-bis[2-[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-|279-016-7|4,4 -Bis[[1-(2,4-dimethylphenylcarbamoyl)-2-oxopropyl]azo]biphenyl-2,2 -disulfonic acid|4,4 -Bis[[1-[[(2,4-dimethylphenyl)amino]carbonyl]-2-oxopropyl]azo]-1,1 -biphenyl-2,2 -disulfonic acid|4,4'-bis(2-{1-[(2,4-dimethylphenyl)carbamoyl]-2-oxopropyl}diazen-1-yl)-[1,1'-biphenyl]-2,2'-disulfonic acid|4,4'-Bis{[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl}[1,1'-biphenyl]-2,2'-disulfonic acid|5-[1-[(2,4-dimethylphenyl)amino]-1,3-dioxobutan-2-yl]diazenyl-2-[4-[1-[(2,4-dimethylphenyl)amino]-1,3-dioxobutan-2-yl]diazenyl-2-sulfophenyl]benzenesulfonic acid

CAS: 78952-69-9
Molecular Formula C36H36N6O10S2
Molecular Weight 776.1934 g/mol
LogP 5.8
Topological Polar Surface Area 267.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 14
Rotatable Bonds 13
Exact Mass 776.1934
Monoisotopic Mass 776.1934
Heavy Atoms 54
Complexity 1520.0

Chemical Identifiers

CAS Number 78952-69-9
SMILES CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)S(=O)(=O)O)S(=O)(=O)O)C
InChIKey ZVYYAZLGILHNEO-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Coatings & Adhesives (3 patents) Dyes & Pigments (6 patents)

Product Overview

AC1Q1JAP (CAS 78952-69-9), with molecular formula C36H36N6O10S2 and molecular weight 776.1934 g/mol. IUPAC: 5-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-[4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfophenyl]benzenesulfonic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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