Ethyl 2-(3-formyl-4-nitrophenoxy)acetate

Base Information

• Chemical Name: Ethyl 2-(3-formyl-4-nitrophenoxy)acetate
• CAS No.: 105728-02-7
• Molecular Formula: C11H11NO6
• Molecular Weight: 253.211
• DSSTox Substance ID: DTXSID20548515
• Wikidata: Q82427243
• Mol file: 105728-02-7.mol

Synonyms:105728-02-7;Ethyl 2-(3-formyl-4-nitrophenoxy)acetate;Ethyl (3-formyl-4-nitrophenoxy)acetate;Ethyl2-(3-formyl-4-nitrophenoxy)acetate;SCHEMBL7312583;DTXSID20548515;Ethyl(3-formyl-4-nitrophenoxy)acetate

Chemical Property of Ethyl 2-(3-formyl-4-nitrophenoxy)acetate

Chemical Property:

• Vapor Pressure: 2.85E-07mmHg at 25°C
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 253.05863707
• Heavy Atom Count: 18
• Complexity: 313

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)COC1=CC(=C(C=C1)[N+](=O)[O-])C=O

Technology Process of Ethyl 2-(3-formyl-4-nitrophenoxy)acetate

There total 1 articles about Ethyl 2-(3-formyl-4-nitrophenoxy)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: 89.0%

2-nitro-5-hydroxybenzaldehyde (42454-06-8) + ethyl bromoacetate (105-36-2) → (3-Formyl-4-nitro-phenoxy)-acetic acid ethyl ester (105728-02-7)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide;

DOI:10.1021/jm00385a012

Reference yield: 78.0%

(3-Formyl-4-nitro-phenoxy)-acetic acid ethyl ester (105728-02-7) → 2-(3-formyl-4-nitrophenyl)oxyacetic acid (105728-06-1)

Guidance literature:

With potassium hydroxide;

DOI:10.1021/jm00385a012

Reference yield: 72.0%

1,3-cylohexanedione (504-02-9) + (3-Formyl-4-nitro-phenoxy)-acetic acid ethyl ester (105728-02-7) → [3-(1,8-Dioxo-1,2,3,4,5,6,7,8,9,10-decahydro-acridin-9-yl)-4-nitro-phenoxy]-acetic acid ethyl ester (138744-23-7)

Guidance literature:

With ammonium hydroxide; In ethanol; for 4h; Heating;

upstream raw materials:

2-nitro-5-hydroxybenzaldehyde

ethyl bromoacetate

Downstream raw materials:

[3-(1,8-Dioxo-1,2,3,4,5,6,7,8,9,10-decahydro-acridin-9-yl)-4-nitro-phenoxy]-acetic acid ethyl ester

{3-[2,5-Dioxo-imidazolidin-(4Z)-ylidenemethyl]-4-nitro-phenoxy}-acetic acid ethyl ester

2-(3-formyl-4-nitrophenyl)oxyacetic acid

N-Cyclohexyl-2-(3-formyl-4-nitro-phenoxy)-N-methyl-acetamide