(2,4-Dinitrophenyl) methanesulfonate

Base Information

• Chemical Name: (2,4-Dinitrophenyl) methanesulfonate
• CAS No.: 7155-37-5
• Molecular Formula: C7H6 N2 O7 S
• Molecular Weight: 262.2
• NSC Number: 19785
• DSSTox Substance ID: DTXSID50281024
• Wikidata: Q82014753
• Mol file: 7155-37-5.mol

Synonyms:7155-37-5;(2,4-dinitrophenyl)methanesulfonate;(2,4-dinitrophenyl) methanesulfonate;NSC19785;2,4-dinitrophenyl mesylate;DTXSID50281024;NSC-19785

Chemical Property of (2,4-Dinitrophenyl) methanesulfonate

Chemical Property:

• Vapor Pressure: 4.47E-08mmHg at 25°C
• Refractive Index: 1.598
• Boiling Point: 456.2°Cat760mmHg
• Flash Point: 229.7°C
• Density: 1.657g/cm³
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 261.98957171
• Heavy Atom Count: 17
• Complexity: 403

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of (2,4-Dinitrophenyl) methanesulfonate

There total 2 articles about (2,4-Dinitrophenyl) methanesulfonate 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) + methanesulfonyl chloride (124-63-0) → 2,4-dinitrophenyl methanesulfonate (7155-37-5)

Guidance literature:

With pyridine;

DOI:10.1021/jo01137a029

Reference yield:

phenyl methanesulfonate (16156-59-5) → 2,4-dinitrophenyl methanesulfonate (7155-37-5)

Guidance literature:

With sulfuric acid; potassium nitrate;

Reference yield:

2,4-dinitrophenyl methanesulfonate (7155-37-5) + aniline (62-53-3) → N-phenyl-2,4-dinitroaniline (961-68-2)

Guidance literature:

In 1,4-dioxane; at 10 - 70 ℃; Kinetics; further compounds;

upstream raw materials:

phenyl methanesulfonate

2,4-Dinitrophenol

methanesulfonyl chloride

Downstream raw materials:

N-phenyl-2,4-dinitroaniline

2,4-dinitrophenolate

Refernces