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Acid Blue 102
[CAS# 6856-08-2]

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CAS#: 6856-08-2
Product: Acid Blue 102
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Identification
Name Acid Blue 102
Synonyms Benzo(A)Phenazinium, 9-((3-Methoxyphenyl)Amino)-7-Phenyl-5-(Phenylamino)-4,10-Disulfo-, Inner Salt, Monosodium Salt; Hydrogen 9-((3-Methoxyphenyl)Amino)-7-Phenyl-5-(Phenylamino)-4,10-Disulphonatobenzo(A)Phenazinium, Sodium Salt
Molecular Structure CAS#: 6856-08-2, Acid Blue 102
Molecular Formula C35H25N4Na2O7S2
Molecular Weight 723.70
CAS Registry Number 6856-08-2
EINECS 229-951-1
SMILES C4=C(NC1=CC=CC=C1)C7=C(C5=NC3=CC(=C(NC2=CC(=CC=C2)OC)C=C3[N+](=C45)C6=CC=CC=C6)[S]([O-])(=O)=O)C=CC=C7[S]([O-])(=O)=O.[Na+].[Na+]
InChI 1S/C35H26N4O7S2.2Na/c1-46-25-15-8-12-23(18-25)37-28-19-30-27(21-33(28)48(43,44)45)38-35-26-16-9-17-32(47(40,41)42)34(26)29(36-22-10-4-2-5-11-22)20-31(35)39(30)24-13-6-3-7-14-24;;/h2-21H,1H3,(H3,36,37,40,41,42,43,44,45);;/q;2*+1/p-1
InChIKey XQUCXIWCWZOCPY-UHFFFAOYSA-M
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