3-Methyl-3-[2-(2,4,6-trimethylphenyl)ethyl]thietan-2-one

Base Information

Chemical Name:3-Methyl-3-[2-(2,4,6-trimethylphenyl)ethyl]thietan-2-one
CAS No.:112303-85-2
Molecular Formula:C15H20OS
Molecular Weight:248.389
Hs Code.:
DSSTox Substance ID:DTXSID10555556

Synonyms:112303-85-2;3-Methyl-3-[2-(2,4,6-trimethylphenyl)ethyl]thietan-2-one;DTXSID10555556

Suppliers and Price of 3-Methyl-3-[2-(2,4,6-trimethylphenyl)ethyl]thietan-2-one

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of 3-Methyl-3-[2-(2,4,6-trimethylphenyl)ethyl]thietan-2-one

Chemical Property:

XLogP3:4.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:248.12348643
Heavy Atom Count:17
Complexity:289

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=C(C(=C1)C)CCC2(CSC2=O)C)C

Technology Process of 3-Methyl-3-[2-(2,4,6-trimethylphenyl)ethyl]thietan-2-one

There total 11 articles about 3-Methyl-3-[2-(2,4,6-trimethylphenyl)ethyl]thietan-2-one 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: 27.0%

: 112303-74-9
S-ethyl 2-(bromomethyl)-4-mesityl-2-methylbutanethioate

: 112303-85-2
3-Methyl-3-[2-(2,4,6-trimethyl-phenyl)-ethyl]-thietan-2-one

: 112303-78-3
2-(Et-thio)carbonyl-2-(mesitylethyl)propane

: 112303-81-8
2-Methylene-4-(2,4,6-trimethyl-phenyl)-thiobutyric acid S-ethyl ester

Guidance literature:: With pyridine; Dimethylglyoxime; sodium methylate; cobalt(II) chloride; zinc; In benzene; for 4h; Product distribution; Mechanism; Irradiation; also other S-substituted (tert-butyl); also other solvents; also other bromides;
DOI:10.1021/ja00222a025

Reference yield:

: 114739-05-8
S-ethyl 4-mesitylbutanethioate

: 112303-85-2
3-Methyl-3-[2-(2,4,6-trimethyl-phenyl)-ethyl]-thietan-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: diisopropylamine, butyllithium / tetrahydrofuran / 1 h / -90 °C

2: LDA / tetrahydrofuran / 0.83 h / -90 °C

3: 1 percent / Co(II)Cl₂, dimethylglyoxime, sodium methoxide, pyridine, powdered zinc / benzene / 4 h / Irradiation; also other S-substituted (tert-butyl); also other solvents; also other bromides

With pyridine; n-butyllithium; Dimethylglyoxime; sodium methylate; diisopropylamine; cobalt(II) chloride; zinc; lithium diisopropyl amide; In tetrahydrofuran; benzene;
DOI:10.1021/ja00222a025

Reference yield:

: 112303-88-5
S-ethyl 4-mesityl-2-methylbutanethioate

: 112303-85-2
3-Methyl-3-[2-(2,4,6-trimethyl-phenyl)-ethyl]-thietan-2-one

Guidance literature:: Multi-step reaction with 2 steps

1: LDA / tetrahydrofuran / 0.83 h / -90 °C

2: 1 percent / Co(II)Cl₂, dimethylglyoxime, sodium methoxide, pyridine, powdered zinc / benzene / 4 h / Irradiation; also other S-substituted (tert-butyl); also other solvents; also other bromides

With pyridine; Dimethylglyoxime; sodium methylate; cobalt(II) chloride; zinc; lithium diisopropyl amide; In tetrahydrofuran; benzene;
DOI:10.1021/ja00222a025