Ethyl 4-[(3-fluoro-4-methoxyphenyl)sulfanyl]-3-oxobutanoate

Base Information

Chemical Name:Ethyl 4-[(3-fluoro-4-methoxyphenyl)sulfanyl]-3-oxobutanoate
CAS No.:89818-29-1
Molecular Formula:C₁₃H₁₅FO₄S
Molecular Weight:286.324
Hs Code.:
DSSTox Substance ID:DTXSID10531037
Wikidata:Q82402585

Synonyms:89818-29-1;DTXSID10531037;Ethyl 4-[(3-fluoro-4-methoxyphenyl)sulfanyl]-3-oxobutanoate

Suppliers and Price of Ethyl 4-[(3-fluoro-4-methoxyphenyl)sulfanyl]-3-oxobutanoate

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
Packaging
price

Total 2 raw suppliers

Chemical Property of Ethyl 4-[(3-fluoro-4-methoxyphenyl)sulfanyl]-3-oxobutanoate

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:286.06750829
Heavy Atom Count:19
Complexity:311

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CC(=O)CSC1=CC(=C(C=C1)OC)F

Technology Process of Ethyl 4-[(3-fluoro-4-methoxyphenyl)sulfanyl]-3-oxobutanoate

There total 3 articles about Ethyl 4-[(3-fluoro-4-methoxyphenyl)sulfanyl]-3-oxobutanoate 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: 95.8%

: 638-07-3
ethyl (2-chloroaceto)acetate

: 89818-27-9
3-fluoro-4-methoxybenzenethiol

: 89818-29-1
ethyl 3-fluoro-4-methoxyphenylthioacetoacetate

Guidance literature:: In pyridine; diethyl ether; for 2h; Heating;
DOI:10.1002/jhet.5570200651

Reference yield:

: 321-28-8
1-fluoro-2-methoxybenzene

: 89818-29-1
ethyl 3-fluoro-4-methoxyphenylthioacetoacetate

Guidance literature:: Multi-step reaction with 3 steps

1: 77 percent / acetic acid; acetic anhydride / 7 h / Ambient temperature

2: 93 percent / LAH / diethyl ether / 2 h / Heating

3: 95.8 percent / diethyl ether; pyridine / 2 h / Heating

With lithium aluminium tetrahydride; In pyridine; diethyl ether; acetic anhydride; acetic acid;
DOI:10.1002/jhet.5570200651

Reference yield:

: 89818-26-8
3-fluoro-4-methoxyphenylisothiocyanate

: 89818-29-1
ethyl 3-fluoro-4-methoxyphenylthioacetoacetate

Guidance literature:: Multi-step reaction with 2 steps

1: 93 percent / LAH / diethyl ether / 2 h / Heating

2: 95.8 percent / diethyl ether; pyridine / 2 h / Heating

With lithium aluminium tetrahydride; In pyridine; diethyl ether;
DOI:10.1002/jhet.5570200651