N-(2-Methoxy-4-nitrophenyl)acetamide

Base Information

• Chemical Name: N-(2-Methoxy-4-nitrophenyl)acetamide
• CAS No.: 93-27-6
• Molecular Formula: C9H10 N2 O4
• Molecular Weight: 210.189
• Hs Code.: 2924299090
• European Community (EC) Number: 202-234-0
• UNII: 39XSR5VP2J
• DSSTox Substance ID: DTXSID5059084
• Nikkaji Number: J154.693G
• Wikidata: Q27894069
• Mol file: 93-27-6.mol

Synonyms:N-(2-Methoxy-4-nitrophenyl)acetamide;93-27-6;Acetamide, N-(2-methoxy-4-nitrophenyl)-;2-Acetylamino-5-nitroanisole;CCRIS 1979;EINECS 202-234-0;39XSR5VP2J;2'-Methoxy-4'-nitroacetanilide;MFCD00024461;N-(2-methoxy-4-nitrophenyl)-acetamid;N-(2-Methoxy-4-nitro-phenyl)acetamide;Acetamide,N-(2-methoxy-4-nitrophenyl)-;5-Nitro-2-(acetylamino)anisole;UNII-39XSR5VP2J;Oprea1_295866;DTXSID5059084;SCHEMBL10657826;4'-NITRO-O-ACETANISIDIDE;O-ACETANISIDIDE, 4'-NITRO-;BBL104294;N-(2-methoxy-4-nitrophenyl)acetamid;STL199107;AKOS002807994;N-(2-methoxy-4-nitrophenyl )acetamide;n-(2-methoxy-4-nitro-phenyl)-acetamide;LS-07424;ACETOACET-2-METHOXY-4-NITROANILIDE;LS-188099;CS-0187539;FT-0631463;2-ACETAMIDO-1-METHOXY-5-NITROBENZENE;2-ACETYLAMINO-1-METHOXY-5-NITROBENZENE;E10139;N-(2-METHOXY-4-NITROPHENYL) ACETAMIDE;Q27894069

Chemical Property of N-(2-Methoxy-4-nitrophenyl)acetamide

Chemical Property:

• Vapor Pressure: 6.49E-07mmHg at 25°C
• Melting Point: 139.5-140.5 °C(Solv: methanol (67-56-1))
• Boiling Point: 409.5 °C at 760 mmHg
• PKA: 13.29±0.70(Predicted)
• Flash Point: 201.4 °C
• PSA: 84.15000
• Density: 1.327 g/cm³
• LogP: 2.15800
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 210.06405680
• Heavy Atom Count: 15
• Complexity: 251

Purity/Quality:

99% ^*data from raw suppliers

N-(2-Methoxy-4-nitrophenyl)acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

Technology Process of N-(2-Methoxy-4-nitrophenyl)acetamide

There total 13 articles about N-(2-Methoxy-4-nitrophenyl)acetamide 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%

acetic anhydride (108-24-7) + 2-methoxy-4-nitrophenylamine (97-52-9) → 5-nitro-2-acetylaminoanisole (93-27-6)

Guidance literature:

With pyridine; dmap; In dichloromethane; Ambient temperature;

DOI:10.1021/jo00039a015

Reference yield: 71.0%

acetic anhydride (108-24-7) + 2-methoxy-phenylamine (90-04-0) → 5-nitro-2-acetylaminoanisole (93-27-6) + N-(2-methoxy-5-nitrophenyl)acetamide (33721-54-9)

Guidance literature:

With bismuth (III) nitrate pentahydrate; In dichloromethane; at 23 ℃; regioselective reaction;

DOI:10.1016/j.tet.2013.08.076

Reference yield:

2-methoxyacetanilide (93-26-5) → 5-nitro-2-acetylaminoanisole (93-27-6)

Guidance literature:

With nitric acid; acetic acid;

upstream raw materials:

2-methoxyacetanilide

acetic anhydride

2-methoxy-phenylamine

N-(2-hydroxy-4-nitrophenyl)acetamide

Downstream raw materials:

2-methoxy-4-nitrophenol

thioacetic acid-(2-methoxy-4-nitro-anilide)

acetic acid-(2-methoxy-4,5-dinitro-anilide)

4-iodo-2-methoxyphenyl acetamide

Refernces

• 1、 -. "Continuous synthesis method 2 -acetylamino -5 - nitroanisole". Paragraph 0005; 0021-0030; 0037-0038; 0032-0036. . Retrieved 2021/11/03.
• 2、 Mologni, Luca,Dalla Via, Martina,Chilin, Adriana,Palumbo, Manlio,Marzaro, Giovanni. "Discovery of wtRET and V804MRET Inhibitors: From Hit to Lead". supporting information. p. 1390 - 1398. Retrieved 2017/09/01.