Trisodium 4-amino-5-hydroxy-3-[[4'-[[4-hydroxy-2-[(o-tolyl)amino]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-6-[(4-sulphonatophenyl)azo]naphthalene-2,7-disulphonate

Base Information

• Chemical Name: Trisodium 4-amino-5-hydroxy-3-[[4'-[[4-hydroxy-2-[(o-tolyl)amino]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-6-[(4-sulphonatophenyl)azo]naphthalene-2,7-disulphonate
• CAS No.: 98705-48-7
• Molecular Formula: C41H32 N8 O11 S3 . x Na
• Molecular Weight: 974.88027
• European Community (EC) Number: 308-870-6
• Mol file: 98705-48-7.mol

Synonyms:2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-((4'-((4-hydroxy-2-((2-methylphenyl)amino)phenyl)azo)(1,1'-biphenyl)-4-yl)azo)-6-((4-sulfophenyl)azo)-, trisodium salt;2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-[[4'-[[4-hydroxy-2-[(2-methylphenyl)amino]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-6-[(4-sulfophenyl)azo]-, trisodium salt;4-Amino-5-hydroxy-3-((4'-((4-hydroxy-2-((o-tolyl)amino)phenyl)azo)(1,1'-biphenyl)-4-yl)azo)-6-((4-sulphophenyl)azo)naphthalene-2,7-disulphonic acid, sodium salt;4-amino-5-hydroxy-3-[[4'-[[4-hydroxy-2-[(o-tolyl)amino]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-6-[(4-sulphophenyl)azo]naphthalene-2,7-disulphonic acid, sodium salt;EINECS 228-784-1;C41H32N8O11S3.xNa;C41H32N8O11S3.3Na;EINECS 308-870-6;C.I. Acid Black 94, trisodium salt;C41-H32-N8-O11-S3.x-Na;C41-H32-N8-O11-S3.3Na;2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-3-(2-(4'-(2-(4-hydroxy-2-((2-methylphenyl)amino)phenyl)diazenyl)(1,1'-biphenyl)-4-yl)diazenyl)-6-(2-(4-sulfophenyl)diazenyl)-, sodium salt (1:3);98705-48-7;Trisodium 4-amino-5-hydroxy-3-[[4'-[[4-hydroxy-2-[(o-tolyl)amino]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-6-[(4-sulphonatophenyl)azo]naphthalene-2,7-disulphonate

Chemical Property of Trisodium 4-amino-5-hydroxy-3-[[4'-[[4-hydroxy-2-[(o-tolyl)amino]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-6-[(4-sulphonatophenyl)azo]naphthalene-2,7-disulphonate

Chemical Property:

• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 9
• Exact Mass: 974.08110014
• Heavy Atom Count: 66
• Complexity: 2200

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=CC=C1NC2=CC(=O)C=CC2=NNC3=CC=C(C=C3)C4=CC=C(C=C4)N=NC5=C(C=C6C=C(C(=NNC7=CC=C(C=C7)S(=O)(=O)[O-])C(=O)C6=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
• Isomeric SMILES: CC1=CC=CC=C1NC\2=CC(=O)C=C/C2=N\NC3=CC=C(C=C3)C4=CC=C(C=C4)N=NC5=C(C=C6C=C(/C(=N\NC7=CC=C(C=C7)S(=O)(=O)[O-])/C(=O)C6=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

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