Allyl methanesulfonate

Base Information

• Chemical Name: Allyl methanesulfonate
• CAS No.: 6728-21-8
• Molecular Formula: C4H8 O3 S
• Molecular Weight: 136.172
• Hs Code.: 2905290000
• European Community (EC) Number: 872-313-8
• DSSTox Substance ID: DTXSID20217618
• Nikkaji Number: J48.658B
• Wikidata: Q83094201
• Mol file: 6728-21-8.mol

Synonyms:allyl methanesulfonate

Chemical Property of Allyl methanesulfonate

Chemical Property:

• Vapor Pressure: 0.0962mmHg at 25°C
• Refractive Index: 1.4640 (estimate)
• Boiling Point: 231.1°C at 760 mmHg
• Flash Point: 93.6°C
• PSA: 51.75000
• Density: 1.163g/cm³
• LogP: 1.22940
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 136.01941529
• Heavy Atom Count: 8
• Complexity: 151

Purity/Quality:

99%, ^*data from raw suppliers

ALLYL METHANESULFONATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)OCC=C

Technology Process of Allyl methanesulfonate

There total 6 articles about Allyl 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: 100.0%

methanesulfonyl chloride (124-63-0) + allyl alcohol (107-18-6) → allyl mesylate (6728-21-8)

Guidance literature:

allyl alcohol; With triethylamine; In dichloromethane; at 25 ℃;

methanesulfonyl chloride; In dichloromethane; at 0 - 20 ℃;

Reference yield: 83.0%

→ allyl methanesulphonate (allyl mesylate) + allyl mesylate (6728-21-8)

Guidance literature:

Reference yield: 45.0%

allyl alcohol (107-18-6) + Methanesulfonic anhydride (7143-01-3) → allyl mesylate (6728-21-8)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 24h; Inert atmosphere;

DOI:10.1021/jacs.6b01694

upstream raw materials:

sodium allyloxide

methanesulfonyl chloride

allyl alcohol

allyl bromide

Downstream raw materials:

3-ethoxyprop-1-ene

1,1-diphenyl-3-buten-1-ol

allylbenzene

2-(1-Allyl-4-hydroxy-piperidin-4-yl)-N-cyclohexyl-N-methyl-propionamide

Refernces

• 1、 Olivito, Fabrizio,Amodio, Nicola,Di Gioia, Maria Luisa,Nardi, Monica,Oliverio, Manuela,Juli, Giada,Tassone, Pierfrancesco,Procopio, Antonio. "Synthesis and preliminary evaluation of the anti-cancer activity on A549 lung cancer cells of a series of unsaturated disulfides". supporting information. p. 116 - 119. Retrieved 2019/01/30.
• 2、 -. "A 2 - ((4R, 6S) - 6-substituted methyl-2-substituent -1,3-dioxane-4-yl) acetate preparation method". Paragraph 0074; 0075. . Retrieved 2017/02/24.