Hydrogen 9-((3-methoxyphenyl)amino)-7-phenyl-5-(phenylamino)-4,10-disulphonatobenzo(a)phenazinium, sodium salt

Base Information

• Chemical Name: Hydrogen 9-((3-methoxyphenyl)amino)-7-phenyl-5-(phenylamino)-4,10-disulphonatobenzo(a)phenazinium, sodium salt
• CAS No.: 6856-08-2
• Deprecated CAS: 98725-14-5
• Molecular Formula: C35H26N4O7S2.Na
• Molecular Weight: 701.74
• European Community (EC) Number: 229-951-1
• DSSTox Substance ID: DTXSID401015436
• Mol file: 6856-08-2.mol

Synonyms:6856-08-2;Hydrogen 9-((3-methoxyphenyl)amino)-7-phenyl-5-(phenylamino)-4,10-disulphonatobenzo(a)phenazinium, sodium salt;Benzo(a)phenazinium, 9-((3-methoxyphenyl)amino)-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, monosodium salt;Benzo[a]phenazinium, 9-[(3-methoxyphenyl)amino]-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, monosodium salt;EINECS 229-951-1;DTXSID401015436;Benzo(a)phenazinium, 9-((3-methoxyphenyl)amino)-7-phenyl-5-(phenylamino)-4,10-disulfo-, inner salt, sodium salt (1:1)

Chemical Property of Hydrogen 9-((3-methoxyphenyl)amino)-7-phenyl-5-(phenylamino)-4,10-disulphonatobenzo(a)phenazinium, sodium salt

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 6
• Exact Mass: 723.09600506
• Heavy Atom Count: 50
• Complexity: 1270

Purity/Quality:

99%, ^*data from raw suppliers

ACID BLUE 102 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)NC2=C(C=C3C(=C2)[N+](=C4C=C(C5=C(C4=N3)C=CC=C5S(=O)(=O)[O-])NC6=CC=CC=C6)C7=CC=CC=C7)S(=O)(=O)[O-].[Na+].[Na+]