Diallyl tetrasulfide

Base Information

• Chemical Name: Diallyl tetrasulfide
• CAS No.: 2444-49-7
• Molecular Formula: C6H10S4
• Molecular Weight: 210.409
• Hs Code.: 2930909090
• European Community (EC) Number: 219-485-7
• NSC Number: 750226
• UNII: WRP12IW1D7
• DSSTox Substance ID: DTXSID70179196
• Nikkaji Number: J216.085D
• Wikidata: Q27292795
• Metabolomics Workbench ID: 45940
• ChEMBL ID: CHEMBL1947232
• Mol file: 2444-49-7.mol

Synonyms:diallyl tetrasulfide;diallyltetrasulfide

Chemical Property of Diallyl tetrasulfide

Chemical Property:

• Vapor Pressure: 0.00692mmHg at 25°C
• Refractive Index: 1.623
• Boiling Point: 279.2 °C at 760 mmHg
• Flash Point: 120.9 °C
• PSA: 101.20000
• Density: 1.211 g/cm³
• LogP: 4.03620
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 209.96653501
• Heavy Atom Count: 10
• Complexity: 79.7

Purity/Quality:

99%, ^*data from raw suppliers

Diallyl Tetrasulfide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCSSSSCC=C
• Uses: Diallyl Tetrasulfide is a mitotic inhibitor and apoptosis inducers. An anti-carcinogenic agent.Also, it is derived from Allyl Bromide (A549655), which is used as a reagent in the synthesis of Resveratrol derivatives. Resveratrol (R150000) is a minor constitutent of wine, correlated with serum lipid reduction and inhibition of platelet aggregation. Resveratrol is a specific inhibitor of COX-1, and it also inhibits the hydroperoxidase activity of COX-1. It has been shown to inhibit events associated with tumor initiation, promotion and progression.

Technology Process of Diallyl tetrasulfide

There total 25 articles about Diallyl tetrasulfide 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: 30.0%

prop-2-ene-1-thiol (870-23-5) → diallyl tetrasulfide (2444-49-7)

Guidance literature:

With disulfur dichloride; triethylamine; In diethyl ether; at -78 ℃; Inert atmosphere;

DOI:10.1039/d1gc03242a

Reference yield: 10.0%

3-chloroprop-1-ene (107-05-1) → diallyl trisulfide (2050-87-5) + diallyl tetrasulfide (2444-49-7)

Guidance literature:

With sulfur; potassium hydroxide; water; In tetrahydrofuran; for 2h; Ambient temperature;

DOI:10.1055/s-1980-29271

Reference yield:

3-chloroprop-1-ene (107-05-1) → diallyl disulphide (2179-57-9) + diallyl sulphide (592-88-1) + diallyl trisulfide (2050-87-5) + diallyl tetrasulfide (2444-49-7)

Guidance literature:

With sodium sulfide; sodium hydroxide; sulfur; polyethylene glycol; In water; at 45 - 60 ℃; under 1173.78 Torr;

3-chloroprop-1-ene; In water; at 45 - 50 ℃; under 915.2 - 4897.34 Torr; Product distribution / selectivity; continuous process;

upstream raw materials:

prop-2-ene-1-thiol

diallyl disulphide

3-chloroprop-1-ene

allyl bromide

Downstream raw materials:

diallyl sulphide

Refernces

• 1、 -. "GARLIC PROCESSING". Page/Page column 5-6; 8. . Retrieved 2008/12/05.
• 2、 Do, Quang Tho,Elothmani, Driss,Simonet, Jacques,Guillanton, Georges Le. "Use of a sacriflcial-sulfur electrode in electroorganic chemistry. V. Formation of the sequence CSSSC from S and thiols or thiolates". . p. 273 - 281. Retrieved 2007/10/03.