2-(4-Nitrophenoxy)acetamide

Base Information

• Chemical Name: 2-(4-Nitrophenoxy)acetamide
• CAS No.: 63218-14-4
• Molecular Formula: C8H8N2O4
• Molecular Weight: 196.163
• DSSTox Substance ID: DTXSID50350002
• Wikidata: Q82125670
• Mol file: 63218-14-4.mol

Synonyms:2-(4-nitrophenoxy)acetamide;63218-14-4;MFCD00466100;4-Nitrophenoxyacetamide;(4-Nitrophenoxy)acetamide;Cambridge id 5211659;Oprea1_792209;CBDivE_005702;SCHEMBL432126;4-(carbamoylmethoxy)nitrobenzene;DTXSID50350002;IYJAUHBAFQALLE-UHFFFAOYSA-N;O-aminocarbonylmethyl-4-nitrophenol;STK059925;AKOS001303702;AB06255;UPCMLD0ENAT5695590:001;LS-07658;EN300-26259;Z19730176

Chemical Property of 2-(4-Nitrophenoxy)acetamide

Chemical Property:

• Melting Point: 157 °C
• Boiling Point: 463.6±25.0 °C(Predicted)
• PKA: 14.71±0.40(Predicted)
• PSA: 99.13000
• Density: 1.375±0.06 g/cm3(Predicted)
• LogP: 2.13180
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 196.04840674
• Heavy Atom Count: 14
• Complexity: 218

Purity/Quality:

98%min ^*data from raw suppliers

2-(4-nitrophenoxy)acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)N

Technology Process of 2-(4-Nitrophenoxy)acetamide

There total 9 articles about 2-(4-Nitrophenoxy)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: 99.0%

2-(4-nitrophenoxy)acetonitrile (33901-46-1) → 4-nitrophenoxyacetamide (63218-14-4)

Guidance literature:

With manganese(IV) oxide; water; In isopropyl alcohol; at 70 ℃; for 0.25h; under 5171.62 Torr;

DOI:10.1021/ol403591c

Reference yield: 84.0%

4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + bromo-acetic acid amide (683-57-8) → 4-nitrophenoxyacetamide (63218-14-4)

Guidance literature:

With potassium carbonate; In acetone; at 20 ℃; for 24h;

Reference yield:

4-nitrophenoxyacetic acid (1798-11-4) → 4-nitrophenoxyacetamide (63218-14-4)

Guidance literature:

With ammonium hydroxide;

upstream raw materials:

2-(4-nitrophenoxy)acetyl chloride

4-nitrophenoxyacetic acid

potassium 4-nitrophenolate

Chloroacetamide

Downstream raw materials:

4-(carbamoylmethoxy)aniline

N₄-(4-aminocarbonylmethyloxyphenyl)-2-chloro-5-fluoro-4-pyrimidineamine

2-chloro-N₄-(4-(cyanomethyloxy)phenyl)-5-fluoro-4-pyrimidineamine

Gca-pNA

Refernces

• 1、 Battilocchio, Claudio,Hawkins, Joel M.,Ley, Steven V.. "Mild and selective heterogeneous catalytic hydration of nitriles to amides by flowing through manganese dioxide". supporting information. p. 1060 - 1063. Retrieved 2016/10/17.
• 2、 -. "Condensed 4-aminopyridines with antirheumatic activity". . . Retrieved 2008/06/13.