Bis(2,4-dinitrophenyl) oxalate

Base Information

• Chemical Name: Bis(2,4-dinitrophenyl) oxalate
• CAS No.: 16536-30-4
• Molecular Formula: C14H6 N4 O12
• Molecular Weight: 422.221
• Hs Code.: 2917119000
• European Community (EC) Number: 628-468-7
• UNII: A4Q7NQ4ENT
• DSSTox Substance ID: DTXSID90167934
• Nikkaji Number: J207.985B
• Wikipedia: Bis(2,4-dinitrophenyl)_oxalate
• Wikidata: Q4917155
• Mol file: 16536-30-4.mol

Synonyms:bis(2,4-dinitrophenyl) oxalate;DNPO

Chemical Property of Bis(2,4-dinitrophenyl) oxalate

Chemical Property:

• Appearance/Colour: light yellow powder
• Vapor Pressure: 1.36E-14mmHg at 25°C
• Melting Point: 189-190 °C(lit.)
• Boiling Point: 605.1 ºC at 760 mmHg
• Flash Point: 265.9 ºC
• PSA: 235.88000
• Density: 1.759 g/cm³
• LogP: 3.92320
• Storage Temp.: −20°C
• Solubility.: soluble in Benzene,Toluene
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 5
• Exact Mass: 421.99822164
• Heavy Atom Count: 30
• Complexity: 673

Purity/Quality:

99% ^*data from raw suppliers

Bis(2,4-dinitrophenyl) Oxalate [Chemiluminescence reagent for the determination of fluorescent compounds by HPLC and FIA] >98.0%(T) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC(=O)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
• Uses: Bis(2,4-dinitrophenyl) oxalate was used in detection of fluorescent compound dansylalanine in buffer solution by flow injection analysis.

Technology Process of Bis(2,4-dinitrophenyl) oxalate

There total 1 articles about Bis(2,4-dinitrophenyl) oxalate 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:

2,4-Dinitrophenol (51-28-5) + oxalyl dichloride (79-37-8) → bis(2,4-dinitrophenyl) oxalate (16536-30-4)

Guidance literature:

With triethylamine;

DOI:10.1021/ja01001a025

Reference yield: 21.0%

(pentamethylcyclopentadienyl)(1,2-bis(diphenylphosphino)ethane)RuC2H (583884-57-5) + bis(2,4-dinitrophenyl) oxalate (16536-30-4) → ((C6H5)2PCH2)2((CH3)5C5)Ru(C4O(O)2(C6H3(NO2)2))

Guidance literature:

In tetrahydrofuran; under dry N2; mixture of Ru-compd. and oxalate-compd. dissolved in THF, stirred for 3 h; solv. removed, flash column chromy. (silica, acetone-hexane, 3/7), elem.anal.;

DOI:10.1016/j.jorganchem.2011.07.020

Reference yield:

bis(2,4-dinitrophenyl) oxalate (16536-30-4) → 2,4-Dinitrophenol (51-28-5)

Guidance literature:

With PERYLENE; dihydrogen peroxide; In ethyl acetate; at 22 ℃; Kinetics;

DOI:10.1039/b206367k

upstream raw materials:

2,4-Dinitrophenol

oxalyl dichloride

Downstream raw materials:

2,4-Dinitrophenol

1,1'-oxalyldiimidazole

Refernces

• 1、 Parsons, Brendon A.,Smith, Olivia Lin,Dragojlovic, Veljko. "An optimised procedure for PTFE phase vanishing reactions: An improved reaction design and the use of reagents adsorbed on silica". . p. 574 - 581. Retrieved 2015/11/27.