(4-methoxypyridin-2-yl)methyl Acetate

Base Information

• Chemical Name: (4-methoxypyridin-2-yl)methyl Acetate
• CAS No.: 16665-37-5
• Molecular Formula: C9H11 N O3
• Molecular Weight: 181.191
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID50443968
• Nikkaji Number: J1.350.465B
• Wikidata: Q82261969
• Mol file: 16665-37-5.mol

Synonyms:(4-methoxypyridin-2-yl)methyl Acetate;16665-37-5;ACETIC ACID 4-METHOXY-PYRIDIN-2-YLMETHYL ESTER;2-Pyridinemethanol, 4-methoxy-, 2-acetate;SCHEMBL9814691;DTXSID50443968;2-Acetoxymethyl-4-methoxypyridine;WFCRVEDHQYCQAL-UHFFFAOYSA-N;AKOS005068140;AC-17989;Acetic acid 4-methoxypyridine-2-ylmethyl ester

Chemical Property of (4-methoxypyridin-2-yl)methyl Acetate

Chemical Property:

• Vapor Pressure: 0.013mmHg at 25°C
• Refractive Index: 1.501
• Boiling Point: 259.9°C at 760 mmHg
• Flash Point: 110.984°C
• PSA: 48.42000
• Density: 1.136g/cm³
• LogP: 1.15330
• Storage Temp.: 2-8°C
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 181.07389321
• Heavy Atom Count: 13
• Complexity: 172

Purity/Quality:

95+% ^*data from raw suppliers

(4-Methoxypyridin-2-yl)methylacetate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OCC1=NC=CC(=C1)OC

Technology Process of (4-methoxypyridin-2-yl)methyl Acetate

There total 7 articles about (4-methoxypyridin-2-yl)methyl Acetate 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: 100.0%

4-methoxy-2-methylpyridine 1-oxide (6890-60-4) + acetic anhydride (108-24-7) → (4-methoxypyridin-2-yl)methyl acetate (16665-37-5)

Guidance literature:

at 110 ℃;

DOI:10.1021/jm970165r

Reference yield: 78.0%

4-methoxy-2-methylpyridine 1-oxide (6890-60-4) → (4-methoxypyridin-2-yl)methyl acetate (16665-37-5)

Guidance literature:

In acetic anhydride;

Reference yield:

2-methyl-4-nitropyridine N-oxide (5470-66-6) → (4-methoxypyridin-2-yl)methyl acetate (16665-37-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 79.1 percent / methanol / 1.5 h / 20 °C

2: 0.5 h / 110 - 120 °C

In methanol;

DOI:10.1248/cpb.48.1514

upstream raw materials:

4-methoxy-2-methylpyridine 1-oxide

acetic anhydride

2-methylpyridine N-oxide

2-methyl-4-nitropyridine N-oxide

Downstream raw materials:

4-methoxy-2-(hydroxymethyl)pyridine

2-chloromethyl-4-methoxypyridine

2-Chloromethyl-4-methoxypyridine hydrochloride

2-(4-Methoxy-pyridin-2-ylmethylsulfanyl)-6-phenyl-3H-thieno[3,4-d]imidazole