2,6-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-

Base Information

• Chemical Name: 2,6-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-
• CAS No.: 84-50-4
• Deprecated CAS: 860527-70-4
• Molecular Formula: C14H8 O8 S2
• Molecular Weight: 368.345
• Hs Code.: 2914399090
• European Community (EC) Number: 201-534-9
• UNII: WN018KNQ7W
• DSSTox Substance ID: DTXSID3058905
• Nikkaji Number: J79.432E
• Wikidata: Q27158338
• ChEMBL ID: CHEMBL3747842
• Mol file: 84-50-4.mol

Synonyms:anthraquinone-2,6-disulfonate;anthraquinone-2,6-disulphonate;AQDS cpd

Chemical Property of 2,6-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-

Chemical Property:

• Melting Point: 325°C
• PKA: -1.85±0.20(Predicted)
• PSA: 159.64000
• Density: 1.800±0.06 g/cm3(Predicted)
• LogP: 3.11700
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 367.96605956
• Heavy Atom Count: 24
• Complexity: 692

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1S(=O)(=O)O)C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)O

Technology Process of 2,6-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-

There total 14 articles about 2,6-Anthracenedisulfonic acid, 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:

sulfuric acid (7664-93-9) + 9,10-phenanthrenequinone (84-65-1) → 2-sulfo-anthraquinone (84-48-0) + Anthraquinone-2,6-disulfonic acid (84-50-4) + anthraquinone-2,7-disulfonic acid (84-49-1)

Guidance literature:

Reference yield:

→ Anthraquinone-2,6-disulfonic acid (84-50-4) + anthraquinone-2,7-disulfonic acid (84-49-1)

Guidance literature:

With sulfuric acid; sulfur trioxide; at 150 ℃;

Reference yield:

2-Benzoylbenzoic acid (85-52-9) → Anthraquinone-2,6-disulfonic acid (84-50-4) + anthraquinone-2,7-disulfonic acid (84-49-1)

Guidance literature:

With sulfuric acid; sulfur trioxide; at 155 ℃;

upstream raw materials:

2-Benzoylbenzoic acid

9,10-phenanthrenequinone

sulfuric acid

sulfur trioxide

Downstream raw materials:

3,4-Dihydroxybenzoic acid

anthraflavic acid

2,3,6-trihydroxyacetophenone

1,2,6-trihydroxyanthraquinone

Refernces