2-Tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)-phenylmethyl]-4-methylphenol

Base Information

• Chemical Name: 2-Tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)-phenylmethyl]-4-methylphenol
• CAS No.: 17619-06-6
• Molecular Formula: C29H36O2
• Molecular Weight: 416.604
• DSSTox Substance ID: DTXSID00404105
• Nikkaji Number: J1.650.762H
• Wikidata: Q82208100
• Mol file: 17619-06-6.mol

Synonyms:17619-06-6;2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)-phenylmethyl]-4-methylphenol;ST033391;SCHEMBL5170392;DTXSID00404105;AKOS024280593

Chemical Property of 2-Tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)-phenylmethyl]-4-methylphenol

Chemical Property:

• XLogP3: 8.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 416.271530387
• Heavy Atom Count: 31
• Complexity: 522

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C2=CC=CC=C2)C3=C(C(=CC(=C3)C)C(C)(C)C)O

Technology Process of 2-Tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)-phenylmethyl]-4-methylphenol

There total 2 articles about 2-Tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)-phenylmethyl]-4-methylphenol 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: 90.0%

p-cresol (106-44-5) + tert-butyl methyl ether (1634-04-4) + benzaldehyde (100-52-7) → 6,6-(phenylmethylene)bis(2-(tert-butyl)4-methylphenol) (17619-06-6)

Guidance literature:

With sulfonated multi-walled carbon nanotubes; In neat (no solvent); at 100 ℃; for 4.7h; regiospecific reaction; Catalytic behavior;

DOI:10.1139/cjc-2013-0160

Reference yield: 50.0%

2-tert-Butyl-4-methylphenol (2409-55-4) + benzaldehyde (100-52-7) → 6,6-(phenylmethylene)bis(2-(tert-butyl)4-methylphenol) (17619-06-6)

Guidance literature:

With toluene-4-sulfonic acid; In hexane; at 20 - 70 ℃; for 15h;

Reference yield: 83.0%

6,6-(phenylmethylene)bis(2-(tert-butyl)4-methylphenol) (17619-06-6) + triethylaluminum (97-93-8) → C31H39AlO2

Guidance literature:

In hexane; toluene; at 20 ℃; for 7h; Inert atmosphere;

upstream raw materials:

2-tert-Butyl-4-methylphenol

benzaldehyde

p-cresol

tert-butyl methyl ether

Refernces

• 1、 Fareghi-Alamdari, Reza,Golestanzadeh, Mohsen,Agend, Farima,Zekri, Negar. "Regiospecific, one-pot, and pseudo-five-component synthesis of 6,6′-(arylmethylene)bis(2-(tert -butyl)4-methylphenol) antioxidants using highly sulfonated multi-walled carbon nanotubes under solvent-free conditions". . p. 982 - 991. Retrieved 2013/10/08.