Toliodium

Base Information

• Chemical Name: Toliodium
• CAS No.: 46449-56-3
• Molecular Formula: C14H14I
• Molecular Weight: 309.17
• UNII: 5O5133M1F7
• DSSTox Substance ID: DTXSID10196842
• Nikkaji Number: J237.953H
• Wikidata: Q27262625
• NCI Thesaurus Code: C87274
• ChEMBL ID: CHEMBL2111155
• Mol file: 46449-56-3.mol

Synonyms:Toliodium;Toliodium ion;Toliodium cation;46449-56-3;Di-p-tolyliodonium;UNII-5O5133M1F7;5O5133M1F7;C14H14I.Br;C14-H14-I.Br;Iodonium, bis(4-methylphenyl)-;bis(4-methylphenyl)iodonium;SCHEMBL125171;CHEMBL2111155;DTXSID10196842;FT-0696638;Q27262625

Chemical Property of Toliodium

Chemical Property:

• XLogP3: 5.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 309.01402
• Heavy Atom Count: 15
• Complexity: 154

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C

Technology Process of Toliodium

There total 1 articles about Toliodium 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: 92.0%

4-tolyl iodide (624-31-7) + acetic anhydride (108-24-7) + toluene (108-88-3,15644-74-3,16713-13-6) → (4-iodophenyl)methyl acetate (90347-65-2) + 4,4'-dimethyldiphenyliodonium cation (46449-56-3) + 2,4'-dimethyldiphenyliodonium cation

Guidance literature:

With sulfuric acid; acetic anhydride; In acetic acid; Further Variations:; reagent concentration; current density; Product distribution; Electrolysis;

DOI:10.1016/S0040-4039(00)01620-8

Reference yield: 84.0%

2-methyl-benzyl alcohol (89-95-2) + 4,4'-dimethyldiphenyliodonium cation (46449-56-3) → 2-hydroxy-4'-methylbenzophenone (19434-30-1)

Guidance literature:

With sodium carbonate; lithium chloride; palladium dichloride; In N,N-dimethyl-formamide; at 40 ℃; for 3h;

DOI:10.1080/00397910008087349

Reference yield: 78.0%

4,4'-dimethyldiphenyliodonium cation (46449-56-3) + 5-chlorosalicyclaldehyde (635-93-8) → (5-chloro-2-hydroxyphenyl)(p-tolyl)methanone (116544-78-6)

Guidance literature:

With sodium carbonate; lithium chloride; palladium dichloride; In N,N-dimethyl-formamide; at 50 ℃; for 3h;

DOI:10.1080/00397910008087349

upstream raw materials:

4-tolyl iodide

acetic anhydride

toluene

Downstream raw materials:

dipropyl p-tolylphosphonate

diethyl 4-methylphenylphosphonate

2-hydroxy-4'-methylbenzophenone

(4-methylphenyl)(2-hydroxy-5-methylphenyl)methanone