4-tert-Butyl-2,6-diiodophenol

Base Information

• Chemical Name: 4-tert-Butyl-2,6-diiodophenol
• CAS No.: 75908-75-7
• Molecular Formula: C10H12I2O
• Molecular Weight: 402.014
• DSSTox Substance ID: DTXSID20436802
• Nikkaji Number: J1.974.807C
• Wikidata: Q82252121
• Mol file: 75908-75-7.mol

Synonyms:4-tert-Butyl-2,6-diiodophenol;75908-75-7;Phenol, 4-(1,1-dimethylethyl)-2,6-diiodo-;SCHEMBL7930120;2,6-Diiodo-4-tert-butylphenol;DTXSID20436802;BS-24525;FT-0751256

Chemical Property of 4-tert-Butyl-2,6-diiodophenol

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 401.89776
• Heavy Atom Count: 13
• Complexity: 164

Purity/Quality:

99%min. ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-tert-Butyl-2,6-diiodophenol

There total 3 articles about 4-tert-Butyl-2,6-diiodophenol 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: 97.0%

para-tert-butylphenol (98-54-4) → 2,6-diiodo-4-(tert-butyl)phenol (75908-75-7)

Guidance literature:

With sulfuric acid; dihydrogen peroxide; potassium iodide;

DOI:10.1002/chem.201603987

Reference yield: 71.0%

para-tert-butylphenol (98-54-4) → 4-tert-butyl-2-iodophenol (38941-98-9) + 2,6-diiodo-4-(tert-butyl)phenol (75908-75-7)

Guidance literature:

With chloroamine-T; sodium iodide; In N,N-dimethyl-formamide; at 20 ℃;

DOI:10.1016/j.tetlet.2013.03.040

Reference yield:

4-tert-butyl-2-iodophenol (38941-98-9) → 2,6-diiodo-4-(tert-butyl)phenol (75908-75-7)

Guidance literature:

With sulfuric acid; dihydrogen peroxide; potassium iodide; In methanol; at 0 ℃; for 1.5h; Inert atmosphere;

DOI:10.1021/acs.orglett.1c04065

upstream raw materials:

para-tert-butylphenol

4-tert-butyl-2-iodophenol