4-(4-Ethoxy-3-methoxyphenyl)but-3-en-2-one

Base Information

Chemical Name:4-(4-Ethoxy-3-methoxyphenyl)but-3-en-2-one
CAS No.:943596-70-1
Molecular Formula:C₁₃H₁₆O₃
Molecular Weight:220.268
Hs Code.:
ChEMBL ID:CHEMBL463795
DSSTox Substance ID:DTXSID101241567

Synonyms:4-(4-Ethoxy-3-methoxyphenyl)but-3-en-2-one;943596-70-1;855232-57-4;CHEMBL463795;SCHEMBL4937130;DTXSID101241567;CS-0274644;EN300-1857511;(E)-4-(4-Ethoxy-3-methoxyphenyl)but-3-en-2-one;(3E)-4-(4-Ethoxy-3-methoxyphenyl)-3-buten-2-one

Suppliers and Price of 4-(4-Ethoxy-3-methoxyphenyl)but-3-en-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 4-(4-Ethoxy-3-methoxyphenyl)but-3-en-2-one

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:220.109944368
Heavy Atom Count:16
Complexity:248

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC1=C(C=C(C=C1)C=CC(=O)C)OC
Isomeric SMILES:CCOC1=C(C=C(C=C1)/C=C/C(=O)C)OC

Technology Process of 4-(4-Ethoxy-3-methoxyphenyl)but-3-en-2-one

There total 2 articles about 4-(4-Ethoxy-3-methoxyphenyl)but-3-en-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: 66.5%

: 120-25-2
4-ethoxy-3-methoxybenzaldehyde

: 67-64-1
acetone

: 943596-70-1
1t-(3-methoxy-4-ethoxy-phenyl)-buten-⁽¹⁾-one-⁽³⁾

Guidance literature:: 4-ethoxy-3-methoxybenzaldehyde; acetone; sodium hydroxide; In ethanol; water; at 20 ℃; for 24h;

With hydrogenchloride; In ethanol; water; pH=7;

Reference yield: 61.0%

: 74-96-4
ethyl bromide

: 1080-12-2,22214-42-2
(E)-4-(4-hydroxy-3-methoxyphenyl)but-3-ene-2-one

: 943596-70-1
1t-(3-methoxy-4-ethoxy-phenyl)-buten-⁽¹⁾-one-⁽³⁾

Guidance literature:: With potassium carbonate; In acetone; Heating;
DOI:10.1021/np060252z

Reference yield: 69.0%

: 943596-70-1
1t-(3-methoxy-4-ethoxy-phenyl)-buten-⁽¹⁾-one-⁽³⁾

: 1774-47-6
trimethylsulfoxonium iodide

: 1-[2-(4-ethoxy-3-methoxyphenyl)cyclopropyl]ethanone

Guidance literature:: trimethylsulfoxonium iodide; With sodium hydride; In dimethyl sulfoxide; mineral oil; Inert atmosphere;

1t-(3-methoxy-4-ethoxy-phenyl)-buten-⁽¹⁾-one-⁽³⁾; In dimethyl sulfoxide; mineral oil; at 20 - 50 ℃; for 3h; Inert atmosphere;
DOI:10.1002/cbdv.201700077