1-(Diethoxymethyl)-4-nitrobenzene

Base Information

• Chemical Name: 1-(Diethoxymethyl)-4-nitrobenzene
• CAS No.: 2403-62-5
• Molecular Formula: C11H15 N O4
• Molecular Weight: 225.244
• NSC Number: 296502
• DSSTox Substance ID: DTXSID10315713
• Nikkaji Number: J916.669F
• Wikidata: Q82069002
• Mol file: 2403-62-5.mol

Synonyms:NSC296502;2403-62-5;NSC 296502;1-(diethoxymethyl)-4-nitrobenzene;SCHEMBL11692703;DTXSID10315713;p-nitrobenzaldehyde diethyl acetal;NSC-296502

Chemical Property of 1-(Diethoxymethyl)-4-nitrobenzene

Chemical Property:

• Vapor Pressure: 0.00227mmHg at 25°C
• Boiling Point: 298.3°Cat760mmHg
• Flash Point: 116.6°C
• Density: 1.142g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 225.10010796
• Heavy Atom Count: 16
• Complexity: 203

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-(Diethoxymethyl)-4-nitrobenzene

There total 15 articles about 1-(Diethoxymethyl)-4-nitrobenzene 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%

ethanol (64-17-5) + 4-nitrobenzaldehdye (555-16-8) + orthoformic acid triethyl ester (122-51-0) → p-nitrobenzaldehyde diethyl acetal (2403-62-5)

Guidance literature:

With povidone-iodine; at 30 ℃; for 3h; Green chemistry;

DOI:10.1016/j.tet.2021.132250

Reference yield: 99.0%

ethanol (64-17-5) + 4-nitrobenzaldehdye (555-16-8) → p-nitrobenzaldehyde diethyl acetal (2403-62-5)

Guidance literature:

With phosphoric acid functionalized ethanolamine grafted polyacrylonitrile fiber; at 65 ℃; for 3.5h; Green chemistry;

DOI:10.1002/asia.201700846

Reference yield: 98.0%

4-nitrobenzaldehdye (555-16-8) + orthoformic acid triethyl ester (122-51-0) → p-nitrobenzaldehyde diethyl acetal (2403-62-5)

Guidance literature:

With tungsten(VI) chloride; for 0.5h; Ambient temperature;

DOI:10.1080/00397919908086226

upstream raw materials:

4-nitro-benzoyl chloride

ethanol

1-methyl-4-nitrobenzene

4-nitrobenzaldehdye

Downstream raw materials:

1,1,3-Triethoxy-2-brom-3-(p-nitrophenyl)-propan

1-[Ethoxy-(4-nitro-phenyl)-methyl]-1H-[1,2,4]triazole

C₂₃H₂₃N₅O₄S₂

N-(4-nitrobenzylidene)-d-10-camphorsulfonamide