5-Acetyl-1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidin-2-one

Base Information

• Chemical Name: 5-Acetyl-1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidin-2-one
• CAS No.: 59033-13-5
• Molecular Formula: C₁₇H₂₃NO₅
• Molecular Weight: 321.373
• DSSTox Substance ID: DTXSID50495205

Synonyms:59033-13-5;5-Acetyl-1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidin-2-one;DTXSID50495205

Chemical Property of 5-Acetyl-1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidin-2-one

Chemical Property:

• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 321.15762283
• Heavy Atom Count: 23
• Complexity: 427

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1CCC(=O)N(C1)CC(C2=CC(=C(C=C2)OC)OC)O

Technology Process of 5-Acetyl-1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidin-2-one

There total 2 articles about 5-Acetyl-1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidin-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: 9.0%

1-{1-[2-(3,4-Dimethoxy-phenyl)-2-hydroxy-ethyl]-piperidin-3-yl}-ethanone (59032-98-3) → 5-Acetyl-1-[2-(3,4-dimethoxy-phenyl)-2-hydroxy-ethyl]-piperidin-2-one (59033-13-5) + 1-<2-(3,4-dimethoxyphenyl)-2-hydroxyethyl>-1,2,3,4-tetrahydro-5-pyridyl methyl ketone (107343-19-1)

Guidance literature:

With Hg(OAc)2*EDTA;

DOI:10.1248/cpb.33.5316

Reference yield:

→ 5-Acetyl-1-[2-(3,4-dimethoxy-phenyl)-2-hydroxy-ethyl]-piperidin-2-one (59033-13-5)

Guidance literature:

entspr. Piperidin (3c), Hg(OAc)2-EDTA;

upstream raw materials:

1-{1-[2-(3,4-Dimethoxy-phenyl)-2-hydroxy-ethyl]-piperidin-3-yl}-ethanone

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