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[1,1'-biphenyl]-2,2'-disulfonic acid, 4,4'-bis[(2-hydroxy-1-naphthalenyl)azo]-5,5'-dimethyl-, disodium salt

HCID 80963
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Basic information

CAS
6472-50-0
Standard SMILES
Cc1cc(-c2cc(C)c(N=Nc3c(O)ccc4ccccc34)cc2S(=O)(=O)[O-])c(S(=O)(=O)[O-])cc1N=Nc1c(O)ccc2ccccc12.[Na+].[Na+]
InChIKey
UGKYHIDHUKJFGV-UHFFFAOYSA-L
Molecular formula
C34H24N4Na2O8S2
Average molar mass
726.7 g/mol
Monoisotopic mass
726.08309465

Names & identifiers

Preferred name
[1,1'-biphenyl]-2,2'-disulfonic acid, 4,4'-bis[(2-hydroxy-1-naphthalenyl)azo]-5,5'-dimethyl-, disodium salt
IUPAC
disodium;5-[(2-hydroxynaphthalen-1-yl)diazenyl]-2-[4-[(2-hydroxynaphthalen-1-yl)diazenyl]-5-methyl-2-sulfonatophenyl]-4-methylbenzenesulfonate
English name
disodium 4,4'-bis[(2-hydroxy-1-naphthyl)azo]-5,5'-dimethyl[1,1'-biphenyl]-2,2'-disulphonate
Molecular formula
C34H24N4Na2O8S2
Molecular weight
726.6859

Names & synonyms

DTXSID0064383[1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[(2-hydroxy-1-naphthalenyl)azo]-5,5'-dimethyl-, disodium salt(1,1'-Biphenyl)-2,2'-disulfonic acid, 4,4'-bis((2-hydroxy-1-naphthalenyl)azo)-5,5'-dimethyl-, disodium salt(1,1'-Biphenyl)-2,2'-disulfonic acid, 4,4'-bis(2-(2-hydroxy-1-naphthalenyl)diazenyl)-5,5'-dimethyl-, sodium salt (1:2)[1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[2-(2-hydroxy-1-naphthalenyl)diazenyl]-5,5'-dimethyl-, sodium salt (1:2)RefChem:550928DTXCID90443766472-50-0Disodium 4,4'-bis[(2-hydroxy-1-naphthyl)azo]-5,5'-dimethyl[1,1'-biphenyl]-2,2'-disulphonatedisodium;5-[(2-hydroxynaphthalen-1-yl)diazenyl]-2-[4-[(2-hydroxynaphthalen-1-yl)diazenyl]-5-methyl-2-sulfonatophenyl]-4-methylbenzenesulfonateDisodium 4,4'-bis((2-hydroxy-1-naphthyl)azo)-5,5'-dimethyl(1,1'-biphenyl)-2,2'-disulphonateAcid Red 89
Show more names
C.I.Acid Red 89C.I.Acid Red 89:C.I.239104,4'-Bis[(2-hydroxy-1-naphtyl)azo]-5,5'-dimethyl-1,1'-biphenyl-2,2'-disulfonic acid disodium salt

Properties

Computed structural properties

Topological polar surface area
221 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
12
Rotatable bonds
5
Heavy atoms
50
Formal charge
0
Complexity
1,250

Physicochemical properties

EPA Substance Registry System
1 · [1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[(2-hydroxy-1-naphthalenyl)azo]-5,5'-dimethyl-, disodium salt (6472-50-0)
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.

Hazard information

Regulatory Information[1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[(2-hydroxy-1-naphthalenyl)azo]-5,5'-dimethyl-, disodium salt: Does not have an individual approval but may be used under an appropriate group standard

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information[1,1'-Biphenyl]-2,2'-disulfonic acid, 4,4'-bis[2-(2-hydroxy-1-naphthalenyl)diazenyl]-5,5'-dimethyl-, sodium salt (1:2): INACTIVE

Preparation methods

Preparation5-Amino-2-(4-amino-5-methyl-2-sulfophenyl)-4-methylbenzenesulfonic double nitriding, and Naphthalen-2-ol (2 Moore) coupled.

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
1,1-Biphenyl-2,2-disulfonic acid, 4,4-bis(2-hydroxy-1-naphthalenyl)azo-5,5-dimethyl-, disodium salt
4,4'-Bis((2-hydroxy-1-naphthalenyl)azo)-5,5'-dimethyl-(1,1'-biphenyl)-2,2'-disulfonate disodium salt
SCHEMBL29438046EINECS 229-321-6AKOS024429560NS000478635-[(2-hydroxy-1-naphthyl)azo]-2-[4-[(2-hydroxy-1-naphthyl)azo]-5-methyl-2-sulfo-phenyl]-4-methyl-benzenesulfonic acidDisodium 4,4'-bis[(2-hydroxynaphthalen-1-yl)diazenyl]-5,5'-dimethyl[1,1'-biphenyl]-2,2'-disulfonate

Database identifiers

CAS
6472-50-0
PubChem CID
80963
DTXSID
DTXSID0064383
EC Number
229-321-6