(3-Acetyloxypyridin-2-yl)methyl acetate

Base Information

• Chemical Name: (3-Acetyloxypyridin-2-yl)methyl acetate
• CAS No.: 67992-22-7
• Molecular Formula: C10H11NO4
• Molecular Weight: 209.202
• European Community (EC) Number: 654-539-7
• NSC Number: 83232
• DSSTox Substance ID: DTXSID90292497
• Wikidata: Q82030823
• Mol file: 67992-22-7.mol

Synonyms:67992-22-7;(3-acetyloxypyridin-2-yl)methyl acetate;2-(ACETOXYMETHYL)-3-ACETOXYPYRIDINE;NSC83232;SCHEMBL4979353;DTXSID90292497;NGPCOYKRSWHSRJ-UHFFFAOYSA-N;NSC-83232;2-acetoxymethyl-pyridin-3-yl acetate;AKOS024323080;[2-(acetyloxymethyl)pyridin-3-yl] acetate;2-[(acetyloxy)methyl]-3-pyridinyl acetate

Chemical Property of (3-Acetyloxypyridin-2-yl)methyl acetate

Chemical Property:

• Vapor Pressure: 0.000896mmHg at 25°C
• Boiling Point: 304°Cat760mmHg
• PKA: 2.16±0.10(Predicted)
• Flash Point: 137.7°C
• PSA: 65.49000
• Density: 1.208g/cm³
• LogP: 1.07000
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 209.06880783
• Heavy Atom Count: 15
• Complexity: 242

Purity/Quality:

99% ^*data from raw suppliers

2-(Acetoxymethyl)-3-acetoxypyridine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OCC1=C(C=CC=N1)OC(=O)C

Technology Process of (3-Acetyloxypyridin-2-yl)methyl acetate

There total 3 articles about (3-Acetyloxypyridin-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:

2-[(dimethylamino)methyl]pyridin-3-ol (2168-13-0) + acetic anhydride (108-24-7) → 3-acetoxy-2-acetoxymethyl-pyridine (67992-22-7)

Guidance literature:

DOI:10.1021/ja01177a006

Reference yield:

→ 3-acetoxy-2-acetoxymethyl-pyridine (67992-22-7)

Guidance literature:

DOI:10.1039/jr9460001104

Reference yield:

→ 3-acetoxy-2-acetoxymethyl-pyridine (67992-22-7)

Guidance literature:

2-Dimethylaminomethyl-3-hydroxypyridin, Acetanhydrid;

upstream raw materials:

2-[(dimethylamino)methyl]pyridin-3-ol

acetic anhydride

Downstream raw materials:

2-methyl-3-pyridinol

2-bromomethyl-3-hydroxypyridine hydrobromide

3-hydroxy-2-hydroxymethylpyridine

Refernces