1-(4-Ethoxyphenyl)butane-1,3-dione

Base Information

Chemical Name:1-(4-Ethoxyphenyl)butane-1,3-dione
CAS No.:51944-10-6
Molecular Formula:C12H14O3
Molecular Weight:206.241
Hs Code.:
DSSTox Substance ID:DTXSID90604177
Wikidata:Q82501967
Mol file:51944-10-6.mol

Synonyms:1-(4-Ethoxyphenyl)butane-1,3-dione;51944-10-6;1,3-Butanedione, 1-(4-ethoxyphenyl)-;SCHEMBL10378531;DTXSID90604177;1,3-Butanedione,1-(4-ethoxyphenyl)-;EN300-1126231

Suppliers and Price of 1-(4-Ethoxyphenyl)butane-1,3-dione

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 3 raw suppliers

Chemical Property of 1-(4-Ethoxyphenyl)butane-1,3-dione

Chemical Property:

Melting Point:44.5 °C
Boiling Point:341.6±17.0 °C(Predicted)
PSA：43.37000
Density:1.076±0.06 g/cm3(Predicted)
LogP:2.24710
XLogP3:1.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:206.094294304
Heavy Atom Count:15
Complexity:227

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=CC=C(C=C1)C(=O)CC(=O)C

Technology Process of 1-(4-Ethoxyphenyl)butane-1,3-dione

There total 2 articles about 1-(4-Ethoxyphenyl)butane-1,3-dione 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: 59.0%

: 141-78-6
ethyl acetate

: 1676-63-7
4'-ethoxyacetophenone

: 51944-10-6
1-(4-ethoxyphenyl)butane-1,3-dione

Guidance literature:: With sodium hydride; at 0 - 20 ℃; for 12h;
DOI:10.1002/adsc.202100228

Reference yield:

: 51944-10-6
1-(4-ethoxyphenyl)butane-1,3-dione

Guidance literature:: 4-Ethoxyacetophenon, Na, Essigsaeureethylester;

Reference yield: 69.0%

: 51944-10-6
1-(4-ethoxyphenyl)butane-1,3-dione

: 333-20-0
potassium thioacyanate

: 4-acetyl-5-(4-ethoxyphenyl)thiazol-2(3H)-one

Guidance literature:: With potassium peroxymonosulfate sulfate; iodine; In 1-methyl-pyrrolidin-2-one; nitromethane; at 140 ℃; for 10h; Inert atmosphere;
DOI:10.1002/adsc.202100228