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1,5-Naphthalenedisulfonic acid, 3,3'-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)(oxido-2,1-diazenediyl)(2-methyl-4,1-phenylene)-2,1-diazenediyl]]bis-, sodium salt (1:6)

HCID 74934026
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Basic information

CAS
72854-12-7
Standard SMILES
Cc1cc(N([O-])N=C2C=CC(=CC=C3C=CC(=N[N+](=O)c4ccc(N=Nc5cc(S(=O)(=O)[O-])c6cccc(S(=O)(=O)[O-])c6c5)c(C)c4)C=C3S(=O)(=O)[O-])C(S(=O)(=O)[O-])=C2)ccc1N=Nc1cc(S(=O)(=O)[O-])c2cccc(S(=O)(=O)[O-])c2c1.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChIKey
UMKXZKXZVBKKRB-UHFFFAOYSA-H
Molecular formula
C48H30N8Na6O20S6
Average molar mass
1,369.146 g/mol
Monoisotopic mass
1,367.92867704

Names & identifiers

Preferred name
1,5-Naphthalenedisulfonic acid, 3,3'-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)(oxido-2,1-diazenediyl)(2-methyl-4,1-phenylene)-2,1-diazenediyl]]bis-, sodium salt (1:6)
IUPAC
Hexasodium 3-({4-[(4-{2-[4-({4-[(4,8-disulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl}-ONN-azoxy)-2-sulfonatophenyl]ethenyl}-3-sulfonatophenyl)-NNO-azoxy]-2-methylphenyl}diazenyl)naphthalene-1,5-disulfonate

Database identifiers

CAS
72854-12-7
PubChem CID
74934026
DTXSID
DTXSID00890307

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