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Ethanesulfonic acid, 2,2'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(1-methyl-2-triazene-3,1-diyl))bis-, sodium salt (1:2)

HCID 86902
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
17011-51-7
Standard SMILES
COc1cc(-c2ccc(N=NN(C)CCS(=O)(=O)[O-])c(OC)c2)ccc1N=NN(C)CCS(=O)(=O)[O-].[Na+].[Na+]
InChIKey
LLTLPCRATLSODZ-UHFFFAOYSA-L
Molecular formula
C20H26N6Na2O8S2
Average molar mass
588.6 g/mol
Monoisotopic mass
588.10489272

Names & identifiers

Preferred name
Ethanesulfonic acid, 2,2'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(1-methyl-2-triazene-3,1-diyl))bis-, sodium salt (1:2)
IUPAC
disodium;2-[[[2-methoxy-4-[3-methoxy-4-[[methyl(2-sulfonatoethyl)amino]diazenyl]phenyl]phenyl]diazenyl]-methylamino]ethanesulfonate

Names & synonyms

17011-51-7DTXSID80889658EINECS 241-085-62,2'-((3,3'-Dimethoxy-4,4'-biphenylene)bis(azo(methylamino)))diethanesulfonic acid, disodium salt2,2'-((2,2'-Dimethoxy-4,4'-biphenylene)bis(azo(methylimino)))di(ethanesulfonic acid), disodium saltEthanesulfonic acid, 2,2'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(1-methyl-2-triazene-3,1-diyl))bis-, disodium saltEthanesulfonic acid, 2,2'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(1-methyl-2-triazene-3,1-diyl))bis-, sodium salt (1:2)Ethanesulfonic acid, 2,2'-((3,3'-dimethoxy-4,4'-biphenylene)bis(azo(methylimino)))di-, disodium saltEthanesulfonic acid, 2,2'-(3-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(1-methyl)-2-triazenyl)bis-, disodium saltEthanesulfonic acid, 2,2'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(1-methyl-2-triazene-3,1-diyl)]bis-, sodium salt (1:2)N,N'-((3,3'-Dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(N-methyl-2-aminoethanesulfonic acid), disodium saltEthanesulfonic acid, 2,2'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(1-methyl-2-triazene-3,1-diyl)]bis-, disodium salt
Show more names
RefChem:138158DTXCID001028910disodium 2,2'-{(3,3'-dimethoxybiphenyl-4,4'-diyl)bis[(1e)-3-methyltriaz-1-ene-1,3-diyl]}diethanesulfonatedisodium;2-[[[2-methoxy-4-[3-methoxy-4-[[methyl(2-sulfonatoethyl)amino]diazenyl]phenyl]phenyl]diazenyl]-methylamino]ethanesulfonateDTXSID10275843LLTLPCRATLSODZ-UHFFFAOYSA-L879632-55-0Disodium 2,2'-((3,3'-dimethoxy-4,4'-biphenylylene)bis(azo(methylimino)))di(ethanesulphonate)

Properties

Computed structural properties

Topological polar surface area
206 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
14
Rotatable bonds
11
Heavy atoms
38
Formal charge
0
Complexity
834

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationEthanesulfonic acid, 2,2'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(1-methyl-2-triazene-3,1-diyl)]bis-, sodium salt (1:2): INACTIVE

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
17011-51-7、879632-55-0
PubChem CID
86902
DTXSID
DTXSID80889658
EC Number
241-085-6
Nikkaji
J318.324F