3-benzyloxy-1H-pyridin-4-one

Base Information

• Chemical Name: 3-benzyloxy-1H-pyridin-4-one
• CAS No.: 1138-45-0
• Molecular Formula: C12H11NO2
• Molecular Weight: 201.225
• European Community (EC) Number: 820-353-1
• Mol file: 1138-45-0.mol

Synonyms:3-benzyloxy-1H-pyridin-4-one;1138-45-0;3-(Benzyloxy)-1,4-dihydropyridin-4-one;3-phenylmethoxy-1H-pyridin-4-one;SCHEMBL4132879;3-(benzyloxy)-1H-pyridin-4-one;BAA13845;EN300-1693163

Chemical Property of 3-benzyloxy-1H-pyridin-4-one

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 201.078978594
• Heavy Atom Count: 15
• Complexity: 288

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=CNC=CC2=O

Technology Process of 3-benzyloxy-1H-pyridin-4-one

There total 6 articles about 3-benzyloxy-1H-pyridin-4-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: 89.0%

3-Benzyloxy-4-pyrone (61049-67-0) → 3-benzyloxy-4(1H)-pyridone (1138-45-0)

Guidance literature:

With ammonia; In ethanol; water; at 70 ℃; for 24h;

DOI:10.1016/j.ejmech.2016.03.014

Reference yield:

5-benzyloxy-2-hydroxymethyl-4H-pyran-4-one (15771-06-9) → 3-benzyloxy-4(1H)-pyridone (1138-45-0)

Guidance literature:

Multi-step reaction with 3 steps

1: Jones reagent / acetone / 3 h / 20 °C

2: 1-methyl-pyrrolidin-2-one / 4 h / Reflux

3: ammonia / water; ethanol / 24 h / 70 °C

With Jones reagent; ammonia; In 1-methyl-pyrrolidin-2-one; ethanol; water; acetone;

DOI:10.1016/j.ejmech.2016.03.014

Reference yield:

5-(benzyloxy)-4-oxo-4H-pyran-2-carboxylic acid (1219-33-6) → 3-benzyloxy-4(1H)-pyridone (1138-45-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 1-methyl-pyrrolidin-2-one / 4 h / Reflux

2: ammonia / water; ethanol / 24 h / 70 °C

With ammonia; In 1-methyl-pyrrolidin-2-one; ethanol; water;

DOI:10.1016/j.ejmech.2016.03.014

upstream raw materials:

5-hydroxy-2-(hydroxymethyl)-4H-pyran-4-one

5-benzyloxy-2-hydroxymethyl-4H-pyran-4-one

5-(benzyloxy)-4-oxo-4H-pyran-2-carboxylic acid

3-Benzyloxy-4-pyrone