Bis(2-fluoro-2,2-dinitroethyl)ethanedioic acid ester

Base Information

• Chemical Name: Bis(2-fluoro-2,2-dinitroethyl)ethanedioic acid ester
• CAS No.: 34036-26-5
• Molecular Formula: C6H4F2N4O12
• Molecular Weight: 362.1124
• DSSTox Substance ID: DTXSID60187644
• Wikidata: Q83059350

Synonyms:Bis(2-fluoro-2,2-dinitroethyl)ethanedioic acid ester;34036-26-5;DTXSID60187644

Chemical Property of Bis(2-fluoro-2,2-dinitroethyl)ethanedioic acid ester

Chemical Property:

• Vapor Pressure: 4.75E-06mmHg at 25°C
• Boiling Point: 382.4°Cat760mmHg
• Flash Point: 185°C
• Density: 1.841g/cm³
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 7
• Exact Mass: 361.97937790
• Heavy Atom Count: 24
• Complexity: 504

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C([N+](=O)[O-])([N+](=O)[O-])F)OC(=O)C(=O)OCC([N+](=O)[O-])([N+](=O)[O-])F

Technology Process of Bis(2-fluoro-2,2-dinitroethyl)ethanedioic acid ester

There total 3 articles about Bis(2-fluoro-2,2-dinitroethyl)ethanedioic acid ester 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: 75.0%

oxalyl dichloride (79-37-8) + 2-fluoro-2,2-dinitroethanol (17003-75-7) → Bis-(2,2-Dinitro-2-fluoroethyl)-oxalat (34036-26-5)

Guidance literature:

at 80 ℃; for 2h;

DOI:10.1039/c7nj02717f

Reference yield:

2-fluoro-2,2-dinitroethylsulfuric acid (53510-13-7) + oxalic acid (144-62-7,97993-78-7) → Bis-(2,2-Dinitro-2-fluoroethyl)-oxalat (34036-26-5)

Guidance literature:

DOI:10.1007/BF00930163

Reference yield:

→ Bis-(2,2-Dinitro-2-fluoroethyl)-oxalat (34036-26-5)

Guidance literature:

Oxalylchlorid, 2,2-Dinitro-2-fluoroethanol;

DOI:10.1021/je60050a036

upstream raw materials:

2-fluoro-2,2-dinitroethylsulfuric acid

oxalic acid

oxalyl dichloride

2-fluoro-2,2-dinitroethanol

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