5-Acetyl-2-methoxyphenyl acetate

Base Information

• Chemical Name: 5-Acetyl-2-methoxyphenyl acetate
• CAS No.: 60792-88-3
• Molecular Formula: C11H12O4
• Molecular Weight: 208.214
• European Community (EC) Number: 651-803-3
• DSSTox Substance ID: DTXSID00400526
• Wikidata: Q82203530
• Mol file: 60792-88-3.mol

Synonyms:5-Acetyl-2-methoxyphenyl acetate;60792-88-3;(5-acetyl-2-methoxyphenyl) acetate;Ethanone, 1-[3-(acetyloxy)-4-methoxyphenyl]-;1-[3-(Acetyloxy)-4-methoxyphenyl]-ethanone;5-Acetyl-2-methoxyphenylacetate;SCHEMBL10830995;DTXSID00400526;MFCD00197033;STL576607;AKOS024330567;AS-34237;1-[3-(Acetyloxy)-4-methoxyphenyl]ethanone;CS-0049586;A868888

Chemical Property of 5-Acetyl-2-methoxyphenyl acetate

Chemical Property:

• PSA: 52.60000
• LogP: 1.82310
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 208.07355886
• Heavy Atom Count: 15
• Complexity: 249

Purity/Quality:

99% ^*data from raw suppliers

5-Acetyl-2-methoxyphenylAcetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC(=C(C=C1)OC)OC(=O)C
• Uses: 5-Acetyl-2-methoxyphenyl Acetate (cas# 60792-88-3) is a useful compound for preparing combretastatin analogs, diphenylpyrazoles, and diphenylisoxazoles, which are antimitotic agents.

Technology Process of 5-Acetyl-2-methoxyphenyl acetate

There total 4 articles about 5-Acetyl-2-methoxyphenyl 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:

acetic anhydride (108-24-7) + 2-methoxy-phenol (90-05-1) → 2-methoxyphenyl acetate (613-70-7) + 3-acetoxy-4-methoxyacetophenone (60792-88-3)

Guidance literature:

With sulfuric acid; at 25 ℃;

Reference yield:

sulfuric acid (7664-93-9) + acetic anhydride (108-24-7) + 2-methoxy-phenol (90-05-1) → 2-methoxyphenyl acetate (613-70-7) + 3-acetoxy-4-methoxyacetophenone (60792-88-3)

Guidance literature:

at 80 ℃;

Reference yield:

2-methoxyphenyl acetate (613-70-7) + acetyl chloride (75-36-5) → 3-acetoxy-4-methoxyacetophenone (60792-88-3)

Guidance literature:

With tin(IV) chloride; In nitromethane; Ambient temperature;

upstream raw materials:

acetic anhydride

2-methoxy-phenol

2-methoxyphenyl acetate

acetyl chloride

Downstream raw materials:

(2E)-1-(3-hydroxy-4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

1-(3-acetoxy-4-methoxy-phenyl)-2-hydroxy-2-isopropoxy-ethanone

2-(3-hydroxy-4-methoxyphenyl)-2-oxoacetaldehyde

(3-Acetoxy-4-methoxy-phenyl)-glyoxal

Refernces

• 1、 Chernyshova, Natalia B.,Tsyganov, Dmitry V.,Khrustalev, Victor N.,Raihstat, Mikhail M.,Konyushkin, Leonid D.,Semenov, Roman V.,Semenova, Marina N.,Semenov, Victor V.. "Synthesis and antimitotic properties of ortho-substituted polymethoxydiarylazolopyrimidines". . p. 151 - 165. Retrieved 2021/03/30.