RefChem:446065

tris(barium(2+));bis(3-hydroxy-4-[(1-sulfonatonaphthalen-2-yl)diazenyl]naphthalene-2,7-disulfonate)

Also Known As: C20H14N2O10S3.3/2Ba|C20-H14-N2-O10-S3.3/2Ba|2,7-Naphthalenedisulfonic acid, 3-hydroxy-4-((1-sulfo-2-naphthalenyl)azo)-, barium salt (2:3)|2,7-Naphthalenedisulfonic acid, 3-hydroxy-4-[(1-sulfo-2-naphthalenyl)azo]-, barium salt (2:3)|1-Naphthalenesulfonic acid, 2-((2-hydroxy-3,6-disulfonic acid-1-naphthalenyl)azo), barium salt (3:2)|2,7-Naphthalenedisulfonic acid, 3-hydroxy-4-(2-(1-sulfo-2-naphthalenyl)diazenyl)-, barium salt (2:3)|Barium 3-hydroxy-4-[(1-sulfonatonaphthalen-2-yl)diazenyl]naphthalene-2,7-disulfonate (3/2)|2,7-Naphthalenedisulfonic acid, 3-hydroxy-4-[(1-sulfo-2-naphthalenyl)azo]-, barium salt (3:2)|2,7-Naphthalenedisulfonic acid, 3-hydroxy-4-[2-(1-sulfo-2-naphthalenyl)diazenyl]-, barium salt (2:3)

Molecular Formula	C40H22Ba3N4O20S6
Molecular Weight	1483.6309 g/mol
LogP	4.51
Topological Polar Surface Area	433.1 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	24
Rotatable Bonds	10
Exact Mass	1483.6309
Heavy Atoms	73
Complexity	4060.3

Chemical Identifiers

CAS Number	70729-66-7
SMILES	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])N=NC3=C4C=CC(=CC4=CC(=C3O)S(=O)(=O)[O-])S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])N=NC3=C4C=CC(=CC4=CC(=C3O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ba+2].[Ba+2].[Ba+2]