2,4-Dinitrophenyl acetate

Base Information

• Chemical Name: 2,4-Dinitrophenyl acetate
• CAS No.: 4232-27-3
• Molecular Formula: C8H6N2O6
• Molecular Weight: 226.145
• Hs Code.: 2915390090
• European Community (EC) Number: 224-189-6
• NSC Number: 99812
• UNII: 917I71M979
• DSSTox Substance ID: DTXSID9063372
• Nikkaji Number: J205.657G
• Wikidata: Q27271385
• Mol file: 4232-27-3.mol

Synonyms:2,4-DINITROPHENYL ACETATE;4232-27-3;(2,4-dinitrophenyl) acetate;Phenol, 2,4-dinitro-, acetate (ester);Phenol, 2,4-dinitro-, 1-acetate;Phenol, 2,4-dinitro-, acetate;UNII-917I71M979;EINECS 224-189-6;NSC 99812;NSC-99812;AI3-00482;917I71M979;NSC99812;ghl.PD_Mitscher_leg0.305;SCHEMBL823705;DTXSID9063372;CDMLJWCAUSWULM-UHFFFAOYSA-;BCP33686;MFCD00041876;Phenol,4-dinitro-, acetate (ester);AKOS024258318;2,4-DINITROPHENYLACETATE,95%;s10118;AS-54444;CS-0213232;FT-0610211;A20412;Q27271385

Chemical Property of 2,4-Dinitrophenyl acetate

Chemical Property:

• Vapor Pressure: 1.47E-05mmHg at 25°C
• Melting Point: 69oC
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 366.4°Cat760mmHg
• Flash Point: 180.2°C
• PSA: 117.94000
• Density: 1.5g/cm³
• LogP: 2.47470
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 226.02258592
• Heavy Atom Count: 16
• Complexity: 307

Purity/Quality:

97% ^*data from raw suppliers

2,4-DINITROPHENYL ACETATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Other Aromatics (Nitrogen)
• Canonical SMILES: CC(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 2,4-Dinitrophenyl acetate

There total 8 articles about 2,4-Dinitrophenyl 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: 100.0%

2,4-Dinitrophenol (51-28-5) + 1-ethoxy-2-(trimethylsilyl)vinyl acetate (104293-02-9) → 2,4-dinitrophenyl acetate (4232-27-3)

Guidance literature:

In dichloromethane; at 40 ℃; for 22h;

DOI:10.1055/s-1989-27248

Reference yield: 87.0%

2,4-Dinitrophenol (51-28-5) + acetyl chloride (75-36-5) → 2,4-dinitrophenyl acetate (4232-27-3)

Guidance literature:

With zinc(II) oxide; at 90 ℃; for 0.333333h;

DOI:10.1016/j.tet.2005.09.002

Reference yield: 86.0%

2,4-Dinitrophenol (51-28-5) + acetic anhydride (108-24-7) → 2,4-dinitrophenyl acetate (4232-27-3)

Guidance literature:

With decamolybdodivanadogermanic acid nanoparticles; at 24.84 ℃; for 0.5h; Neat (no solvent);

DOI:10.1590/S0103-50532011000700018

upstream raw materials:

2,4-Dinitrophenol

acetic anhydride

1-ethoxy-2-(trimethylsilyl)vinyl acetate

potassium 2,4-dinitrophenolate

Downstream raw materials:

1-piperidin-1-yl-ethanone

2,4-Dinitrophenol

N-acetylpiperidine

1-acetyl-4-methyl-pyridinium