C32H23ClN10O18S5.5Na

pentasodium;4-[[4-[3-[(2Z)-2-[8-amino-1-oxo-3,6-disulfonato-7-[(2-sulfo-5-sulfonatophenyl)diazenyl]naphthalen-2-ylidene]hydrazinyl]-4-sulfonatoanilino]-6-chloro-1,3,5-triazin-2-yl]amino]benzoate

Also Known As: 4-((4-((3-((8-Amino-1-hydroxy-3,6-disulfo-7-((2,5-disulfophenyl)azo)-2-naphthalenyl)azo)-4-sulfophenyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)benzoic acid, pentasodium salt|Benzoic acid, 4-((4-((3-((8-amino-7-((2,5-disulfophenyl)azo)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-4-sulfophenyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-, pentasodium salt|Benzoic acid, 4-((4-((3-(2-(8-amino-7-(2-(2,5-disulfophenyl)diazenyl)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-4-sulfophenyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:5)|Benzoic acid, 4-[[4-[[3-[[8-amino-7-[(2,5-disulfophenyl)azo]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-4-sulfophenyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-, pentasodium salt

Molecular Formula	C32H18ClN10Na5O18S5
Molecular Weight	1139.8582 g/mol
LogP	-14.0972
Topological Polar Surface Area	478.23 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	27
Rotatable Bonds	14
Exact Mass	1139.8582
Monoisotopic Mass	1139.8582
Heavy Atoms	71
Complexity	3636.0208

Chemical Identifiers

CAS Number	68133-30-2
SMILES	C1=CC(=CC=C1C(=O)[O-])NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N/N=C/4\C(=CC5=CC(=C(C(=C5C4=O)N)N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]