Acetic acid, [[4,6-bis(1,1-dimethylethyl)-2,3-dihydroxyphenyl]thio]-

Base Information

Chemical Name:Acetic acid, [[4,6-bis(1,1-dimethylethyl)-2,3-dihydroxyphenyl]thio]-
CAS No.:94300-08-0
Molecular Formula:C16H24O4S
Molecular Weight:312.43
Hs Code.:
DSSTox Substance ID:DTXSID60442245
Nikkaji Number:J2.173.641D

Synonyms:94300-08-0;Acetic acid, [[4,6-bis(1,1-dimethylethyl)-2,3-dihydroxyphenyl]thio]-;DTXSID60442245;(4,6-Di-tert-butyl-2,3-dihydroxyphenylthio)acetic acid;2-[4,6-di(t-butyl)-2,3-dihydroxyphenylsulfanyl]acetic acid

Suppliers and Price of Acetic acid, [[4,6-bis(1,1-dimethylethyl)-2,3-dihydroxyphenyl]thio]-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of Acetic acid, [[4,6-bis(1,1-dimethylethyl)-2,3-dihydroxyphenyl]thio]-

Chemical Property:

XLogP3:4.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:312.13953042
Heavy Atom Count:21
Complexity:370

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=CC(=C(C(=C1O)O)SCC(=O)O)C(C)(C)C

Technology Process of Acetic acid, [[4,6-bis(1,1-dimethylethyl)-2,3-dihydroxyphenyl]thio]-

There total 3 articles about Acetic acid, [[4,6-bis(1,1-dimethylethyl)-2,3-dihydroxyphenyl]thio]- 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: 76.0%

: 3383-21-9
3,5-di-tert-butyl-o-benzoquinone

: 68-11-1
mercaptoacetic acid

: 94300-08-0
2-{[4,6-di(tert-butyl)-2,3-dihydroxyphenyl]sulfanyl}acetic acid

Guidance literature:: With lithium diisopropyl amide; Product distribution; multistep reaction: 1.) THF, -78 deg C, 20 min, 2.) -78 deg C, 1 h; 22 deg C, 12 h; formation of lithium enolate; tandem aldol-Tishchenko reactions of lithium enolates; stereoselectivity; mechanistic consideration;
DOI:10.1021/jo971012e