1,2-Benzenedicarboxylic acid, 4-(dimethylamino)-

Base Information

• Chemical Name: 1,2-Benzenedicarboxylic acid, 4-(dimethylamino)-
• CAS No.: 39519-77-2
• Molecular Formula: C10H11NO4
• Molecular Weight: 209.202
• DSSTox Substance ID: DTXSID40466883
• Wikidata: Q82293538

Synonyms:39519-77-2;4-dimethylaminophthalic Acid;1,2-Benzenedicarboxylic acid, 4-(dimethylamino)-;SCHEMBL8646935;DTXSID40466883

Chemical Property of 1,2-Benzenedicarboxylic acid, 4-(dimethylamino)-

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 209.06880783
• Heavy Atom Count: 15
• Complexity: 264

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC(=C(C=C1)C(=O)O)C(=O)O

Technology Process of 1,2-Benzenedicarboxylic acid, 4-(dimethylamino)-

There total 3 articles about 1,2-Benzenedicarboxylic acid, 4-(dimethylamino)- 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:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 4-aminophthalic acid (5434-21-9) → 4-(N,N-dimethylamino)phthalic acid (39519-77-2)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; at 20 ℃; for 3h;

DOI:10.1039/b408001g

Reference yield:

6-dimethylamino-1,4-dihydrophthalazine-1,4-dione (71982-97-3) → 5-dimethylamino-2-formylbenzoic acid (63333-22-2) + 4-(N,N-dimethylamino)phthalic acid (39519-77-2) + 4-dimethylamino-2-formylbenzoic acid + 4-dimethylaminophthalhydrazide

Guidance literature:

With Carbonate buffer; ethylenediaminetetraacetic acid; In 1,4-dioxane; Product distribution; Mechanism; effect of pH on the ratio of the products; effect of different added reagents (O₂, N₂, H₂O₂);

DOI:10.1007/BF00957699

Reference yield:

→ 4-(N,N-dimethylamino)phthalic acid (39519-77-2)

Guidance literature:

Saeure (2), AgNO3 in NaOH/H2O <Δ bis 60grad>;

upstream raw materials:

6-dimethylamino-1,4-dihydrophthalazine-1,4-dione

formaldehyd

4-aminophthalic acid

Downstream raw materials:

5-(dimethylamino)-2-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-1H-isoindole-1,3(2H)-dione

5-(dimethylamino)-2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-1H-isoindole-1,3(2H)-dione

5-(dimethylamino)-2-[5-[4-(2-methoxyphenyl)-1-piperazinyl]pentyl]-1H-isoindole-1,3(2H)-dione

5-(dimethylamino)-2-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-1H-isoindole-1,3(2H)-dione

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