Benzoic acid, 5-(2-(4'-(2-(4-(2-(4-amino-7-sulfo-1-naphthalenyl)diazenyl)-6-sulfo-1-naphthalenyl)diazenyl)(1,1'-biphenyl)-4-yl)diazenyl)-2-hydroxy-, sodium salt (1:3)

C.I.31725 · Direct Brown 27 · CIDIRECTBROWN27 · Direct brown 27 (C.I. 31725) · C.I.Direct Brown 27:C.I.31725 · trisodium 5-[[4'-[[4-[(4-amino-7-sulphonato-1-naphthyl)azo]-6-sulphonato-1-naphthyl]azo][1,1'-biphenyl]-4-yl]azo]salicylate · Trisodium 5-((4'-((4-((4-amino-7-sulphonato-1-naphthyl)azo)- 6-sulphonato-1-naphthyl)azo)(1,1'-biphenyl)-4- yl)azo)salicylate · 5-[[4'-[[4-[(4-Amino-7-sulfo-1-naphtyl)azo]-6-sulfo-1-naphtyl]azo]-1,1'-biphenyl-4-yl]azo]-2-hydroxybenzoic acid trisodium salt

https://huagongshe.com/de/chemical/165447

Molekülstruktur von Benzoic acid, 5-(2-(4'-(2-(4-(2-(4-amino-7-sulfo-1-naphthalenyl)diazenyl)-6-sulfo-1-naphthalenyl)diazenyl)(1,1'-biphenyl)-4-yl)diazenyl)-2-hydroxy-, sodium salt (1:3)

Identifikatoren & physikalische Daten

CAS No.	6360-29-8
Summenformel	C39H24N7Na3O9S2
Durchschnittliche Molmasse	867,8 g/mol
Monoisotopische Masse	867,07700056 g/mol
SMILES	Nc1ccc(N=Nc2ccc(N=Nc3ccc(-c4ccc(N=Nc5ccc(O)c(C(=O)[O-])c5)cc4)cc3)c3ccc(S(=O)(=O)[O-])cc23)c2cc(S(=O)(=O)[O-])ccc12.[Na+].[Na+].[Na+]
InChIKey	RJDWQVFKQLBFBW-UHFFFAOYSA-K
PubChem CID	165447
EC No.	228-826-9
DTXSID	DTXSID5064259

Chemische & physikalische Eigenschaften

Polarare Oberfläche (TPSA)	292
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	16
Frei drehbare Bindungen	7
Schwere Atome	60
Formalladung	0
Komplexität	1.660
EPA chemische Informationen	C.I. Direct Brown 27 (6360-29-8)

Sicherheit & Vorschriften

Regulatorische Informationen	S - indicates a substance that is identified in a final Significant New Use Rule.
TSCA-Inventar-Status	TSCA listed

Herstellung & Synthese

synthetische

4-(4-Aminophenyl)benzenamine double nitriding, first coupled with 2-Hydroxybenzoic acid, and with 8-Aminonaphthalene-2-sulfonic acid coupling, its product to diazo, and 5-Aminonaphthalene-2-sulfonic acid coupling.