AC1L4T1M

trisodium;6-amino-5-[[2-sulfonato-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1-sulfonate

Also Known As: 1-Naphthalenesulfonic acid, 6-amino-5-((2-sulfo-4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-, sodium salt|5-bromo-2-(2-tert-butylamino-1-hydroxyethyl)-7-ethylbenzofuran|1-Naphthalenesulfonic acid, 6-amino-5-(2-(2-sulfo-4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl)-, sodium salt (1:?)|1-Naphthalenesulfonic acid, 6-amino-5-[[2-sulfo-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt|1-Naphthalenesulfonic acid, 6-amino-5-[[2-sulfo-4-[[2- (sulfooxy)ethyl]sulfonyl]phenyl]azo]-, sodium salt|6-Amino-5-((2-sulpho-4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)naphthalene-1-sulphonic acid, sodium salt|6-amino-5-[[2-sulpho-4-[[2- ethyl]sulphonyl]phenyl]azo]naphthalene-1-sulphonicacid,sodiumsalt|6-amino-5-[[2-sulpho-4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-1-sulphonic acid, sodium salt|trisodium 6-amino-5-[(e)-(2-sulfonato-4-{[2-(sulfonatooxy)ethyl]sulfonyl}phenyl)diazenyl]naphthalene-1-sulfonate|trisodium 6-amino-5-[[2-sulfonato-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1-sulfonate|trisodium,6-amino-5-[[2-sulfonato-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1-sulfonate

Molecular Formula	C18H14N3Na3O12S4
Molecular Weight	660.91534 g/mol
LogP	-8.0919
Topological Polar Surface Area	299.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	15
Rotatable Bonds	6
Exact Mass	660.91534
Monoisotopic Mass	660.91534
Heavy Atoms	40
Complexity	1220.0

Chemical Identifiers

CAS Number	85536-93-2
SMILES	C1=CC2=C(C=CC(=C2N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N)C(=C1)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChIKey	NBVCGFDCTVVPMH-UHFFFAOYSA-K