Endodan

Base Information

• Chemical Name: Endodan
• CAS No.: 33813-20-6
• Deprecated CAS: 38473-79-9
• Molecular Formula: C4H4 N2 S3
• Molecular Weight: 176.287
• Hs Code.: 2934999025
• European Community (EC) Number: 251-684-4
• UNII: NG03351C2T
• DSSTox Substance ID: DTXSID70187473
• Nikkaji Number: J54.027G
• Wikidata: Q27284850
• Mol file: 33813-20-6.mol

Synonyms:Endodan;ethylene thiuram monosulfide;ethylenebisdiisothiocyanato sulfide;ethylenebisthiuram monosulfide

Chemical Property of Endodan

Chemical Property:

• Vapor Pressure: 0.00546mmHg at 25°C
• Melting Point: 122.5°C
• Refractive Index: 1.5000 (estimate)
• Boiling Point: 274.2°Cat760mmHg
• Flash Point: 119.7°C
• PSA: 105.86000
• Density: 1.89g/cm³
• LogP: 0.69050
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 175.95366166
• Heavy Atom Count: 9
• Complexity: 188

Purity/Quality:

98%Min ^*data from raw suppliers

5,6-DIHYDRO-3H-IMIDAZO[2,1-C]-1,2,4-DITHIAZOLE-3-THIONE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,N
• Statements: 22-50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN2C(=N1)SSC2=S
• Uses: Vegita is a metabolite of fungicide maneb (M163500).

Technology Process of Endodan

There total 3 articles about Endodan 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:

→ etem (33813-20-6)

Guidance literature:

With manganese(IV) oxide; water; oxygen; bei pH 10;

DOI:10.1139/v54-111

Reference yield:

carbon disulfide (75-15-0,12122-00-8) + 2,3,5,6-tetrahydro-2-phenylimidazo<1,2-d>-(1,2,4)-thiadiazole-3-one (80334-62-9) → etem (33813-20-6)

Guidance literature:

Multistep reaction; 1.) chloroform, 2.) ethanol, warming;

DOI:10.1016/S0040-4020(01)88906-7

Reference yield:

→ etem (33813-20-6)

Guidance literature:

a): Dihydroimidazolyl-benzyl-disulfid, CS2;

upstream raw materials:

carbon disulfide

2,3,5,6-tetrahydro-2-phenylimidazo<1,2-d>-(1,2,4)-thiadiazole-3-one

Downstream raw materials:

1-Thiocarbamoyl-2-imidazolidinethione

Refernces

• 1、 Beer, Roger J. S.,Singh, Hardev,Wright, David,Hansen, Lars Kr.. "NOVEL HETEROPENTALENES. SYNTHESIS OF HETEROPENTALENES FROM TETRAHYDROIMIDAZO -(1,2,4)-THIADIAZOLES AND CONVERSION OF CERTAIN HETEROPENTALENES TO BENZOTHIAZOLE DERIVATIVES". . p. 2485 - 2488. Retrieved 2007/10/02.