2,4,5-Triiodobenzoic acid

Base Information

• Chemical Name: 2,4,5-Triiodobenzoic acid
• CAS No.: 35674-21-6
• Molecular Formula: C7H3I3O2
• Molecular Weight: 499.813
• UNII: 1EN9WXQ6AA
• DSSTox Substance ID: DTXSID80405630
• Wikidata: Q27895882
• Mol file: 35674-21-6.mol

Synonyms:2,4,5-triiodobenzoic acid;Benzoic acid, 2,4,5-triiodo-;1EN9WXQ6AA;35674-21-6;UNII-1EN9WXQ6AA;SCHEMBL3190414;DTXSID80405630;Q27895882

Chemical Property of 2,4,5-Triiodobenzoic acid

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 499.7267
• Heavy Atom Count: 12
• Complexity: 186

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(C(=CC(=C1I)I)I)C(=O)O

Technology Process of 2,4,5-Triiodobenzoic acid

There total 2 articles about 2,4,5-Triiodobenzoic 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:

2-amino-4,5-diiodo-benzoic acid (35674-29-4) → 2,4,5-triiodobenzoic acid (35674-21-6)

Guidance literature:

With potassium iodide;

Reference yield:

→ 2,4,5-triiodobenzoic acid (35674-21-6)

Guidance literature:

Reference yield:

tripentaerythritol (78-24-0) + 2,4,5-triiodobenzoic acid (35674-21-6) → C71H40I24O18

Guidance literature:

With dmap; dicyclohexyl-carbodiimide; In tetrahydrofuran; for 12h;

upstream raw materials:

2-amino-4,5-diiodo-benzoic acid

Refernces