Di(2-hydroxy-5-tert-butylphenyl) sulfide

Base Information

• Chemical Name: Di(2-hydroxy-5-tert-butylphenyl) sulfide
• CAS No.: 3273-24-3
• Molecular Formula: C20H26O2S
• Molecular Weight: 330.491
• NSC Number: 2855
• UNII: 950F6F0N23
• DSSTox Substance ID: DTXSID4052007
• Nikkaji Number: J1.611.633E
• Wikidata: Q27271719
• Mol file: 3273-24-3.mol

Synonyms:Di(2-hydroxy-5-tert-butylphenyl) sulfide;3273-24-3;2,2'-sulfanediylbis(4-tert-butylphenol);2,2'-Thiobis(4-tert-Butylphenol);o,o'-p-tert-Butylphenol monosulfide;UNII-950F6F0N23;2,2'-Thiobis(4-t-butylphenol);NSC-2855;950F6F0N23;Phenol, 2,2'-thiobis(4-tert-butyl-;Phenol, 2,2'-thiobis(4-(1,1-dimethylethyl)-;Phenol, 2,2'-thiobis[4-tert-butyl-;Phenol, 2,2'-thiobis[4-(1,1-dimethylethyl)-;NSC2855;4-tert-butyl-2-(5-tert-butyl-2-hydroxyphenyl)sulfanylphenol;Oprea1_074469;SCHEMBL496753;DTXSID4052007;Monosulfide,O'-p-tert-butylphenol;Phenol,2'-thiobis[4-tert-butyl-;NSC 2855;Monosulfide, O,O'-p-tert-butylphenol;AKOS024280594;bis(2-hydroxy-5-t-butylphenyl)sulfide;BIS(4-TERT-BUTYLPHENOL) SULFIDE;Bis(5-tert-butyl-2-hydroxyphenyl) sulfide;Phenol,2'-thiobis[4-(1,1-dimethylethyl)-;2,2'-THIOBIS(4-(1,1-DIMETHYLETHYL)PHENOL);Q27271719;2,2'-DIHYDROXY-5,5'-DI-TERT-BUTYLDIPHENYL SULFIDE

Chemical Property of Di(2-hydroxy-5-tert-butylphenyl) sulfide

Chemical Property:

• XLogP3: 6.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 330.16535124
• Heavy Atom Count: 23
• Complexity: 346

Purity/Quality:

99% ^*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)O)SC2=C(C=CC(=C2)C(C)(C)C)O

Technology Process of Di(2-hydroxy-5-tert-butylphenyl) sulfide

There total 6 articles about Di(2-hydroxy-5-tert-butylphenyl) sulfide 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: 91.0%

para-tert-butylphenol (98-54-4) → 2,2'-thiobis<4-t-butylphenol> (3273-24-3)

Guidance literature:

With sulfur dichloride; In dichloromethane; at 0 ℃; for 1.33333h;

DOI:10.1039/c5cc00819k

Reference yield: 6.0%

para-tert-butylphenol (98-54-4) → 2,2'-thiobis<4-t-butylphenol> (3273-24-3) + 2,6-bis(5-t-butyl-2-hydroxyphenylthio)-4-t-butylphenol (133786-58-0)

Guidance literature:

With sulfur dichloride; In dichloromethane; at 0 ℃; for 1h;

DOI:10.1246/bcsj.64.576

Reference yield:

para-tert-butylphenol (98-54-4) → 2,2'-thiobis<4-t-butylphenol> (3273-24-3) + bis(2-hydroxy-5-tert-butylphenyl) disulfide (19614-80-3)

Guidance literature:

With sulfur dichloride; In hexane; at 62 - 64 ℃; for 2h; Product distribution;

upstream raw materials:

para-tert-butylphenol

glycerol

Downstream raw materials:

4-tert-butyl-2-(5-tert-butyl-2-hydroxyphenylsulfanyl)-6-(hydroxymethyl)phenol

4,4'-di(tert-butyl)-2,2'-bis(hydroxymethyl)-6,6'-sulfandiyldiphenol

bis[5-tert-butyl-2-(trifluoromethylsulfonyloxy)phenyl]sulfan

C₂₂H₂₆O₄S

Refernces

• 1、 Hucko, Michal,Dvoráková, Hana,Eigner, Václav,Lhoták, Pavel. "2,14-Dithiacalix[4]arene and its homooxa analogues: Synthesis and dynamic NMR study of conformational behaviour". supporting information. p. 7051 - 7053. Retrieved 2015/04/22.
• 2、 Brezhneva, L. I.,Vasilevskaya, T. N.,Andrievskii, V. N.,Maksimov, I. E.. "REACTION OF p-tert-BUTYLPHENOL AND 2-METHYL-4-tert-BUTYLPHENOL WITH SULFUR MONO- AND DICHLORIDE". . p. 1723 - 1726. Retrieved 2007/10/02.