2,4,5-Tris(acetyloxy)benzoic acid

Base Information

• Chemical Name: 2,4,5-Tris(acetyloxy)benzoic acid
• CAS No.: 93620-88-3
• Molecular Formula: C13H12O8
• Molecular Weight: 296.233
• DSSTox Substance ID: DTXSID10538703
• Wikidata: Q82414195

Synonyms:93620-88-3;2,4,5-Tris(acetyloxy)benzoic acid;SCHEMBL10939837;DTXSID10538703

Chemical Property of 2,4,5-Tris(acetyloxy)benzoic acid

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 296.05321734
• Heavy Atom Count: 21
• Complexity: 444

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=CC(=C(C=C1C(=O)O)OC(=O)C)OC(=O)C

Technology Process of 2,4,5-Tris(acetyloxy)benzoic acid

There total 2 articles about 2,4,5-Tris(acetyloxy)benzoic 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:

1,2,4-Trihydroxybenzene (533-73-3) → 2,4,5-triacetoxy-benzoic acid (93620-88-3)

Guidance literature:

Multi-step reaction with 2 steps

2: H₂SO₄

With sulfuric acid;

Reference yield:

2,4,5-trihydroxybenzoic acid (610-90-2) + acetic anhydride (108-24-7) → 2,4,5-triacetoxy-benzoic acid (93620-88-3)

Guidance literature:

With sulfuric acid;

Reference yield:

diethyl ether (60-29-7,927820-24-4) + 2,4,5-triacetoxy-benzoic acid (93620-88-3) + ethyl acetoacetate (141-97-9) → ethyl 1-(2,4,5-triacetoxybenzoyl)-3-oxobutanoate

Guidance literature:

With thionyl chloride; In N-methyl-acetamide; water; benzene;

upstream raw materials:

2,4,5-trihydroxybenzoic acid

acetic anhydride

1,2,4-Trihydroxybenzene

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