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4-Hydroxy-5-[[(4-methylphenyl)sulfonyl]amino]-3-[2-(4-nitrophenyl)diazenyl]-2,7-naphthalenedisulfonic acid

HCID 165488
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
85409-49-0
Standard SMILES
Cc1ccc(S(=O)(=O)Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(N=Nc4ccc([N+](=O)[O-])cc4)c(O)c23)cc1
InChIKey
TXXKONXNGGPOSG-UHFFFAOYSA-N
Molecular formula
C23H18N4O11S3
Average molar mass
622.615 g/mol
Monoisotopic mass
622.0134204

Names & identifiers

Preferred name
4-Hydroxy-5-[[(4-methylphenyl)sulfonyl]amino]-3-[2-(4-nitrophenyl)diazenyl]-2,7-naphthalenedisulfonic acid
English name
4-hydroxy-3-[(4-nitrophenyl)azo]-5-[[(p-tolyl)sulphonyl]amino]naphthalene-2,7-disulphonic acid
Molecular formula
C23H18N4O11S3
Molecular weight
622.6

Names & synonyms

Einecs 287-118-84-hydroxy-3-[(4-nitrophenyl)azo]-5-[[(p-tolyl)sulphonyl]amino]naphthalene-2,7-disulphonic acid4-Hydroxy-5-[[(4-methylphenyl)sulfonyl]amino]-3-[(4-nitrophenyl)azo]-2,7-naphthalenedisulfonic acid2,7-Naphthalenedisulfonic acid, 4-hydroxy-5-[[(4-methylphenyl)sulfonyl]amino]-3-[2-(4-nitrophenyl)diazenyl]-

Database identifiers

CAS
85409-49-0
PubChem CID
165488
DTXSID
DTXSID701110041
EC Number
287-118-8
Nikkaji
J333.133D

Properties

Physicochemical properties

Density
1.73 · 1.73±0.1 g/cm3(Predicted)
pka
-0.81 · -0.81±0.40(Predicted)

Related reactions

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