Registration Dossier

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
Tetrasodium 7-(4-(4-chloro-6-(4-(2-sulfooxyethanesulfonyl)ph enylamino)-1,3,5-triazin-2-ylamino)-2-ureido-phenylazo)napht halene-1,3,6-trisulfonate

Inventory

EC number:
474-870-9
EC name:
-
CAS number:
-
CAS number:
80156-97-4

Synonyms

Molecular and structural information

Molecular formula:
Hill formula: C28H20ClN9Na4O16S5
CAS formula: C28H24ClN9O16S5.4Na
Molecular weight:
ca. 1 026.3
SMILES notation:
C1(=CC=C(C=C1)[S](CCO[S]([O-])(=O)=O)(=O)=O)NC2=NC(=NC(=N2)Cl)NC5=CC=C(N=NC4=CC3=C(C=C(C=C3C=C4[S]([O-])(=O)=O)[S](=O)([O-])=O)[S]([O-])(=O)=O)C(=C5)NC(N)=O.[Na+].[Na+].[Na+].[Na+]
InChl:
InChI=1S/C28H24ClN9O16S5/c29-25-34-27(31-15-1-4-17(5-2-15)55(40,41)8-7-54-59(51,52)53)36-28(35-25)32-16-3-6-20(21(11-16)33-26(30)39)37-38-22-13-19-14(10-24(22)58(48,49)50)9-18(56(42,43)44)12-23(19)57(45,46)47/h1-6,9-13H,7-8H2,(H3,30,33,39)(H,42,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H2,31,32,34,35,36)/p-4/b38-37+
Structural formula:
Chemical structure

Related substances