4-Methoxy-3-nitrophenyl acetate

Base Information

• Chemical Name: 4-Methoxy-3-nitrophenyl acetate
• CAS No.: 39653-87-7
• Molecular Formula: C9H9NO5
• Molecular Weight: 211.174
• European Community (EC) Number: 827-873-8
• DSSTox Substance ID: DTXSID101288179
• Wikidata: Q107825184
• Mol file: 39653-87-7.mol

Synonyms:4-methoxy-3-nitrophenyl acetate;39653-87-7;4-Methoxy-3-nitrophenylacetate;Phenol, 4-methoxy-3-nitro-, 1-acetate;2-nitro-4-acetyloxyanisole;2-nitro-4-acetyloxy-anisole;SCHEMBL376107;XUZGGGXQVSZPDD-UHFFFAOYSA-N;DTXSID101288179;AKOS015859733;EN300-169862;G48218

Chemical Property of 4-Methoxy-3-nitrophenyl acetate

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 211.04807239
• Heavy Atom Count: 15
• Complexity: 249

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=CC(=C(C=C1)OC)[N+](=O)[O-]

Technology Process of 4-Methoxy-3-nitrophenyl acetate

There total 5 articles about 4-Methoxy-3-nitrophenyl 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: 76.0%

acetic anhydride (108-24-7) + 4-methoxy-phenol (150-76-5) → 4-methoxy-3-nitrophenyl acetate (39653-87-7)

Guidance literature:

acetic anhydride; 4-methoxy-phenol; In acetic acid; for 1.5h; Heating / reflux;

With nitric acid; In acetic acid; at 0 - 55 ℃; for 1.5h;

Reference yield: 32.0%

2-methoxyphenyl acetate (613-70-7) → 4-methoxy-3-nitrophenyl acetate (39653-87-7)

Guidance literature:

With nitric acid; In chloroform;

Reference yield:

4-methoxyphenyl acetate (1200-06-2) → 4-methoxy-3-nitrophenyl acetate (39653-87-7)

Guidance literature:

With nitric acid; acetic acid; at 10 ℃;

upstream raw materials:

4-methoxyphenyl acetate

nitric acid

acetic acid

acetic anhydride

Downstream raw materials:

4-hydroxy-2-nitroanisole