2-Anthracenesulfonic acid, 1-amino-4-[(3-amino-4-sulfophenyl)amino]-9,10-dihydro-9,10-dioxo-

Base Information

• Chemical Name: 2-Anthracenesulfonic acid, 1-amino-4-[(3-amino-4-sulfophenyl)amino]-9,10-dihydro-9,10-dioxo-
• CAS No.: 128-99-4
• Molecular Formula: C20H15 N3 O8 S2
• Molecular Weight: 489.486
• European Community (EC) Number: 204-926-8
• UNII: 664OYN0ZL9
• DSSTox Substance ID: DTXSID4059594
• Nikkaji Number: J33.359J
• Wikidata: Q27263953
• ChEMBL ID: CHEMBL1208280
• Mol file: 128-99-4.mol

Synonyms:128-99-4;2-Anthracenesulfonic acid, 1-amino-4-[(3-amino-4-sulfophenyl)amino]-9,10-dihydro-9,10-dioxo-;1-amino-4-(3-amino-4-sulfoanilino)-9,10-dioxoanthracene-2-sulfonic acid;EINECS 204-926-8;1-Amino-4-(3'-aminophenylamino)anthraquinone-2,4'-disulfonic acid;UNII-664OYN0ZL9;664OYN0ZL9;1-Amino-4-(3-amino-4-sulphoanilino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonic acid;2-Anthracenesulfonic acid, 1-amino-4-((3-amino-4-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-;SCHEMBL4650171;CHEMBL1208280;DTXSID4059594;W-109473;Q27263953;1-Amino-4-(3-amino-4-sulfoanilino)-9,10-dihydro-9,10-dioxoanthracene-2-sulfonic acid

Chemical Property of 2-Anthracenesulfonic acid, 1-amino-4-[(3-amino-4-sulfophenyl)amino]-9,10-dihydro-9,10-dioxo-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 223.71000
• Density: 1.778g/cm³
• LogP: 5.26040
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 4
• Exact Mass: 489.03005679
• Heavy Atom Count: 33
• Complexity: 1010

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)S(=O)(=O)O)N)S(=O)(=O)O)N

Technology Process of 2-Anthracenesulfonic acid, 1-amino-4-[(3-amino-4-sulfophenyl)amino]-9,10-dihydro-9,10-dioxo-

There total 4 articles about 2-Anthracenesulfonic acid, 1-amino-4-[(3-amino-4-sulfophenyl)amino]-9,10-dihydro-9,10-dioxo- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

1-amino-4-bromo-9,10-dioxoanthracene-2-sulphonic acid (116-81-4) + 2,4-Diaminobenzenesulfonic acid (88-63-1) → 1-amino-4-(3-amino-4-sulfophenylamino)anthraquinone-2-sulfonic acid (128-99-4)

Guidance literature:

With sodium hydrogencarbonate; In water; at 60 ℃; for 17h;

Reference yield:

1-amino-4-bromo-9,10-dioxoanthracene-2-sulphonic acid (116-81-4) + 1,3-phenylenediamine-4-sulphonic acid sodium salt → 1-amino-4-(3-amino-4-sulfophenylamino)anthraquinone-2-sulfonic acid (128-99-4)

Guidance literature:

With 1,4,7,10-tetraazacyclododecane-1,3-diene; sodium hydrogencarbonate; In water; at 80 - 90 ℃; for 4h; pH=9;

Reference yield:

1-amino-4-bromo-9,10-dioxoanthracene-2-sulphonic acid (116-81-4) + 2,4-Diaminobenzenesulfonic acid (88-63-1) → 1-aminoanthraquinone-2-sulfonic acid (83-62-5) + 1-amino-4-hydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid (24929-02-0) + 1-amino-4-(3-amino-4-sulfophenylamino)anthraquinone-2-sulfonic acid (128-99-4)

Guidance literature:

bronze powder; copper(l) iodide; In water; at 40 ℃; Mechanism; Rate constant; various pH, various electrolyte concentrations, various Cu⁽¹⁺⁾ concentrations;

upstream raw materials:

1-amino-4-bromo-9,10-dioxoanthracene-2-sulphonic acid

2,4-Diaminobenzenesulfonic acid

Downstream raw materials:

Reactive blue 4

Refernces

• 1、 -. "METHOD FOR PURIFICATION OF ANTIBODIES, ANTIBODY FRAGMENTS OR ENGINEERED VARIANTS THEREOF USING SPECIFIC ANTHRAQUINONE DYE-LIGAND STRUCTURES". Page/Page column 33; 34. . Retrieved 2015/09/23.
• 2、 Vrba, Zdenek. "MECHANISM OF THE ULLMANN CONDENSATION". . p. 92 - 100. Retrieved 2007/10/02.