2,6-Dimethyl-1,4-oxathiane 4,4-dioxide

Base Information

• Chemical Name: 2,6-Dimethyl-1,4-oxathiane 4,4-dioxide
• CAS No.: 6633-86-9
• Molecular Formula: C6H12O3S
• Molecular Weight: 164.2227
• NSC Number: 51702
• DSSTox Substance ID: DTXSID50287602
• Mol file: 6633-86-9.mol

Synonyms:2,6-dimethyl-1,4-oxathiane 4,4-dioxide;6633-86-9;NSC51702;SCHEMBL2057611;DTXSID50287602;NSC-51702;A838497

Chemical Property of 2,6-Dimethyl-1,4-oxathiane 4,4-dioxide

Chemical Property:

• Vapor Pressure: 0.000676mmHg at 25°C
• Boiling Point: 318.4°Cat760mmHg
• Flash Point: 146.4°C
• Density: 1.139g/cm³
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 164.05071541
• Heavy Atom Count: 10
• Complexity: 186

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CS(=O)(=O)CC(O1)C

Technology Process of 2,6-Dimethyl-1,4-oxathiane 4,4-dioxide

There total 8 articles about 2,6-Dimethyl-1,4-oxathiane 4,4-dioxide 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:

β,β'-dichlorodipropyl sulfone (86240-76-8) → 2,6-dimethyl-[1,4]oxathiane-4,4-dioxide (6633-86-9)

Guidance literature:

With sodium hydroxide; higher-melting optically inactive stereoisomer(ic);

DOI:10.1021/ja01630a017 DOI:10.1039/jr9490002433

Reference yield:

2,6-dimethyl-[1,4]oxathiane (71172-25-3) → 2,6-dimethyl-[1,4]oxathiane-4,4-dioxide (6633-86-9)

Guidance literature:

With peracetic acid; acetic acid; lower-melting optically inactive stereoisomer(ic);

Reference yield:

β,β'-dichlorodipropyl sulfide (22535-54-2) → 2,6-dimethyl-[1,4]oxathiane-4,4-dioxide (6633-86-9)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous hydrogen peroxide

2: aq. NaOH solution

With sodium hydroxide; dihydrogen peroxide;

DOI:10.1021/ja01630a017

upstream raw materials:

diallyl sulfone

bis-(3-chloro-propyl) sulfone

β,β'-dichlorodipropyl sulfone

2,6-dimethyl-[1,4]oxathiane

Refernces

• 1、 Bock,Haberkorn,Herlinger,Mayer,Petersen. "The structure-activity relationship of 4-(5'-nitrofurfurylidene-amino)-tetrahydro-4H-1,4-thiazine-1,1-dioxides active against Trypanosoma cruzi.". . p. 1564 - 1569. Retrieved 2007/10/04.