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4-Amino-3-[2-[4′-[2-(2,4-dihydroxyphenyl)diazenyl][1,1′-biphenyl]-4-yl]diazenyl]-5-hydroxy-6-[2-(4-sulfophenyl)diazenyl]-2,7-naphthalenedisulfonic acid

HCID 136171069
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Basic information

CAS
93920-41-3
Standard SMILES
Nc1c(N=Nc2ccc(-c3ccc(N=Nc4ccc(O)cc4O)cc3)cc2)c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(N=Nc3ccc(S(=O)(=O)O)cc3)c(O)c12
InChIKey
NUELWJVIGMYJMX-UHFFFAOYSA-N
Molecular formula
C34H25N7O12S3
Average molar mass
819.812 g/mol
Monoisotopic mass
819.07233224

Names & identifiers

Preferred name
4-Amino-3-[2-[4′-[2-(2,4-dihydroxyphenyl)diazenyl][1,1′-biphenyl]-4-yl]diazenyl]-5-hydroxy-6-[2-(4-sulfophenyl)diazenyl]-2,7-naphthalenedisulfonic acid
English name
4-amino-3-[[4'-[(2,4-dihydroxyphenyl)azo][1,1'-biphenyl]-4-yl]azo]-5-hydroxy-6-[(4-sulphophenyl)azo]naphthalene-2,7-disulphonic acid
Molecular formula
C34H25N7O12S3
Molecular weight
819.8

Names & synonyms

4-Amino-3-[[4'-[(2,4-dihydroxyphenyl)azo]-1,1'-biphenyl-4-yl]azo]-5-hydroxy-6-[(4-sulfophenyl)azo]-2,7-naphthalenedisulfonic acid4-Amino-3-[[4'-[(2,4-dihydroxyphenyl)azo][1,1'-biphenyl]-4-yl]azo]-5-hydroxy-6-[(4-sulfophenyl)azo]-2,7-naphthalenedisulfonic acid4-amino-3-[[4'-[(2,4-dihydroxyphenyl)azo][1,1'-biphenyl]-4-yl]azo]-5-hydroxy-6-[(4-sulphophenyl)azo]naphthalene-2,7-disulphonic acid2,7-Naphthalenedisulfonic acid, 4-amino-3-[2-[4'-[2-(2,4-dihydroxyphenyl)diazenyl][1,1'-biphenyl]-4-yl]diazenyl]-5-hydroxy-6-[2-(4-sulfophenyl)diazenyl]-

Database identifiers

CAS
93920-41-3
PubChem CID
136171069
DTXSID
DTXSID901100189
EC Number
300-127-4
Nikkaji
J305.141B

Properties

Physicochemical properties

Density
1.72 · 1.72±0.1 g/cm3(Predicted)
pka
-1.29 · -1.29±0.50(Predicted)

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