1,2,5-Thiadiazolidine 1,1-dioxide

Base Information

• Chemical Name: 1,2,5-Thiadiazolidine 1,1-dioxide
• CAS No.: 5823-51-8
• Molecular Formula: C2H6N2O2S
• Molecular Weight: 122.148
• European Community (EC) Number: 861-738-4
• DSSTox Substance ID: DTXSID00440245
• Wikidata: Q72508177
• Mol file: 5823-51-8.mol

Synonyms:1,2,5-thiadiazolidine 1,1-dioxide;5823-51-8;[1,2,5]THIADIAZOLIDINE 1,1-DIOXIDE;1,2,5-Thiadiazolidine, 1,1-dioxide;MFCD04037174;[1,2,5]Thiadiazolidine1,1-dioxide;C2H6N2O2S;SCHEMBL692567;AMY9350;DTXSID00440245;[1,2,5]thiadiazolidine-1,1-dioxide;AKOS006280072;CS-W005346;1lambda6,2,5-thiadiazolidine-1,1-dione;DS-17665;SY103379;FT-0650982;EN300-257378;1,2,5-Thiadiazolidine 1,1-dioxide, AldrichCPR

Chemical Property of 1,2,5-Thiadiazolidine 1,1-dioxide

Chemical Property:

• Vapor Pressure: 3.41E-06mmHg at 25°C
• Melting Point: 171-172 °C
• Refractive Index: 1.643
• Boiling Point: 376.2°C at 760 mmHg
• PKA: 12.39±0.20(Predicted)
• Flash Point: 181.3°C
• PSA: 66.58000
• Density: 1.398 g/cm³
• LogP: 0.16240
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 122.01499861
• Heavy Atom Count: 7
• Complexity: 132

Purity/Quality:

98%,99%, ^*data from raw suppliers

1,2,5-Thiadiazolidine 1,1-dioxide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNS(=O)(=O)N1

Technology Process of 1,2,5-Thiadiazolidine 1,1-dioxide

There total 5 articles about 1,2,5-Thiadiazolidine 1,1-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: 99.0%

2-benzyl-1,2,5-thiadiazolidine 1,1-dioxide (144432-72-4) → 1,2,5-thiadiazolidine 1,1-dioxide (5823-51-8)

Guidance literature:

With water; palladium(II) hydroxide; In methanol; for 16h; under 760.051 Torr;

Reference yield: 10.4%

ethylenediamine (107-15-3,85404-18-8) → 1,2,5-thiadiazolidine 1,1-dioxide (5823-51-8)

Guidance literature:

With SULFAMIDE; In pyridine; for 20h; Heating;

DOI:10.1021/jm00045a006

Reference yield:

SULFAMIDE (7803-58-9) + ethylenediamine (107-15-3,85404-18-8) → 1,2,5-thiadiazolidine 1,1-dioxide (5823-51-8)

Guidance literature:

With pyridine; for 16h; Reflux;

DOI:10.1016/j.bmcl.2008.09.034

upstream raw materials:

2,5-di-tert-butyl-[1,2,5]thiadiazolidine 1,1-dioxide

ethylenediamine

SULFAMIDE

2-benzyl-1,2,5-thiadiazolidine 1,1-dioxide

Downstream raw materials:

C₈H₈FN₃O₄S

C₂₃H₂₃F₅N₂O₅S₂

Refernces

• 1、 Humphries, Paul S.,Bersot, Ross,Kincaid, John,Mabery, Eric,McCluskie, Kerryn,Park, Timothy,Renner, Travis,Riegler, Erin,Steinfeld, Tod,Turtle, Eric D.,Wei, Zhi-Liang,Willis, Erik. "Carbazole-containing sulfonamides and sulfamides: Discovery of cryptochrome modulators as antidiabetic agents". . p. 757 - 760. Retrieved 2016/05/24.
• 2、 Kim, Seoung Jong,Jung, Myung-Ho,Yoo, Kyung Ho,Cho, Jung-Hyuck,Oh, Chang-Hyun. "Synthesis and antibacterial activities of novel oxazolidinones having cyclic sulfonamide moieties". scheme or table. p. 5815 - 5818. Retrieved 2009/11/30.