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Butanamide, 2,2'-[(2,2'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(2,1-diazenediyl)]bis[N-(4-ethoxyphenyl)-3-oxo-

HCID 89278
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Basic information

CAS
20139-66-6
Standard SMILES
CCOc1ccc(NC(=O)C(N=Nc2ccc(-c3ccc(N=NC(C(C)=O)C(=O)Nc4ccc(OCC)cc4)cc3Cl)c(Cl)c2)C(C)=O)cc1
InChIKey
ANRPYVOIZUOOMQ-UHFFFAOYSA-N
Molecular formula
C36H34Cl2N6O6
Average molar mass
717.6 g/mol
Monoisotopic mass
716.1916882

Names & identifiers

Preferred name
Butanamide, 2,2'-[(2,2'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(2,1-diazenediyl)]bis[N-(4-ethoxyphenyl)-3-oxo-
IUPAC
2-[[3-chloro-4-[2-chloro-4-[[1-(4-ethoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(4-ethoxyphenyl)-3-oxobutanamide
English name
p-Acetoacetophenetidide, 2,2''-((2,2'-dichloro-4,4'-biphenylylene)bis(azo))bis-
Molecular formula
C36H34Cl2N6O6
Molecular weight
717.6

Names & synonyms

20139-66-6Butanamide, 2,2'-[(2,2'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[N-(4-ethoxyphenyl)-3-oxo-p-Acetoacetophenetidide, 2,2''-((2,2'-dichloro-4,4'-biphenylylene)bis(azo))bis-DTXSID00885117Butanamide, 2,2'-((2,2'-dichloro(1,1'-biphenyl)-4,4'-diyl)bis(2,1-diazenediyl))bis(N-(4-ethoxyphenyl)-3-oxo-Butanamide, 2,2'-((2,2'-dichloro(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(N-(4-ethoxyphenyl)-3-oxo-Butanamide, 2,2'-[(2,2'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(2,1-diazenediyl)]bis[N-(4-ethoxyphenyl)-3-oxo-RefChem:570590DTXCID601024516606-443-12-[[3-chloro-4-[2-chloro-4-[[1-(4-ethoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(4-ethoxyphenyl)-3-oxobutanamideSCHEMBL20271896
Show more names
2,2'-Dichloro-4,4'-bis[[1-[[(4-ethoxyphenyl)amino]carbonyl]-2-oxopropyl]azo][1,1'-biphenyl]2,2''-[(2,2'-dichloro-4,4'-biphenylylene)bis(azo)]bis-p-Acetoacetophenetidide 2,2''-[(2,2'-dichloro-4,4'-biphenylylene)bis(azo)]bis-p-acetoacetophenetidid

Properties

Computed structural properties

XLogP
8.7
Topological polar surface area
160 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
15
Heavy atoms
50
Formal charge
0
Complexity
1,100

Physicochemical properties

EPA Substance Registry System
2 · Butanamide, 2,2'-[(2,2'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[N-(4-ethoxyphenyl)-3-oxo- (20139-66-6)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (5 of 5) of all reports.

Not Classified

Aggregated GHS information provided per 5 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationButanamide, 2,2'-[(2,2'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(2,1-diazenediyl)]bis[N-(4-ethoxyphenyl)-3-oxo-: ACTIVE

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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ANRPYVOIZUOOMQ-UHFFFAOYSA-N2,2'-[(2,2'-Dichloro[1,1'-biphenyl]-4,4'-diyl)bis(diazene-2,1-diyl)]bis[N-(4-ethoxyphenyl)-3-oxobutanamide]

Database identifiers

CAS
20139-66-6
PubChem CID
89278
DTXSID
DTXSID00885117
EC Number
606-443-1
Nikkaji
J422.054D