Anthracene-2,6-dicarboxylic acid

Base Information

• Chemical Name: Anthracene-2,6-dicarboxylic acid
• CAS No.: 138308-89-1
• Molecular Formula: C16H10O4
• Molecular Weight: 266.253
• Hs Code.: 2917399090
• DSSTox Substance ID: DTXSID30576884
• Nikkaji Number: J1.554.456B
• Wikidata: Q82466759
• Mol file: 138308-89-1.mol

Synonyms:ANTHRACENE-2,6-DICARBOXYLIC ACID;138308-89-1;2,6-Anthracenedicarboxylic acid;2,6-anthracene dicarboxylic acid;2,6-dicarboxyanthracene;SCHEMBL258253;YSCK0211;DTXSID30576884;MFCD04114357;AKOS022180923;CS-0110473;A807370

Chemical Property of Anthracene-2,6-dicarboxylic acid

Chemical Property:

• Boiling Point: 528.2±30.0 °C(Predicted)
• PKA: 3.76±0.30(Predicted)
• PSA: 74.60000
• Density: 1.457±0.06 g/cm3(Predicted)
• LogP: 3.38940
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 266.05790880
• Heavy Atom Count: 20
• Complexity: 367

Purity/Quality:

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

Anthracene-2,6-dicarboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC2=CC3=C(C=C21)C=C(C=C3)C(=O)O)C(=O)O

Technology Process of Anthracene-2,6-dicarboxylic acid

There total 13 articles about Anthracene-2,6-dicarboxylic acid 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: 91.0%

anthraquinone-2,6-dicarboxylic acid (42946-19-0) → 2,6-anthracene dicarboxylic acid (138308-89-1)

Guidance literature:

With ammonium hydroxide; zinc; Heating;

DOI:10.1021/acs.cgd.6b00588

Reference yield: 88.0%

dimethyl 2,6-anthracenedicarbocylate → 2,6-anthracene dicarboxylic acid (138308-89-1)

Guidance literature:

With potassium hydroxide; Reflux;

DOI:10.1002/cssc.202000140

Reference yield:

para-xylene (106-42-3) → isophthalic acid (121-91-5) + terephthalic acid (100-21-0) + diphenic acid (863305-32-2) + 4,4'-benzophenonedicarboxylic acid (964-68-1) + 1,2,4-benzene tricarboxylic acid (528-44-9) + anthraquinone-2,6-dicarboxylic acid (42946-19-0) + fluorenone-2,6-dicarboxylic acid (60505-55-7) + 4-Carboxybenzaldehyde (619-66-9) + 2,6-anthracene dicarboxylic acid (138308-89-1) + p-Toluic acid (99-94-5) + benzoic acid (65-85-0,8013-63-6) + biphenyl-2,4′,5-tricarboxylic acid (34196-40-2)

Guidance literature:

With oxygen; manganese(II) bromide; In water; at 200 - 400 ℃; for 0.0025 - 0.213333h; under 187519 Torr; Industry scale; Near supercritical condition;

upstream raw materials:

anthraquinone-2,6-dicarboxylic acid

2,6-dimethylanthracene-9,10-dione

para-xylene

(2,5-dimethylphenyl)(p-tolyl)methanone

Refernces

• 1、 Becuwe, Matthieu,Fédèle, Lionel,Ouari, Olivier,Sauvage, Frédéric,Thiam, Amadou. "Empowering organic-based negative electrode material based on conjugated lithium carboxylate through molecular design". . . Retrieved 2020.
• 2、 -. "PRODUCTION OF AROMATIC CARBOXYLIC ACIDS". Page 28. . Retrieved 2008/06/13.