Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), tetrakis(2-methylpropyl)-

Base Information

• Chemical Name: Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), tetrakis(2-methylpropyl)-
• CAS No.: 3064-73-1
• Molecular Formula: C18H36N2S4
• Molecular Weight: 408.761
• European Community (EC) Number: 221-312-5
• DSSTox Substance ID: DTXSID7062823
• Nikkaji Number: J141.891B
• Wikidata: Q72467299
• ChEMBL ID: CHEMBL4871643
• Mol file: 3064-73-1.mol

Synonyms:3064-73-1;Disulfide, bis(diisobutylthiocarbamoyl);tetraisobutylthiuram disulfide;Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), tetrakis(2-methylpropyl)-;bis(2-methylpropyl)carbamothioylsulfanyl N,N-bis(2-methylpropyl)carbamodithioate;CHEMBL4871643;Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), N,N,N',N'-tetrakis(2-methylpropyl)-;Thioperoxydicarbonic diamide (((H2N)C(S))2S2), tetrakis(2-methylpropyl)-;Thioperoxydicarbonic diamide (((H2N)C(S))2S2), N,N,N',N'-tetrakis(2-methylpropyl)-;SCHEMBL358578;DTXSID7062823;EINECS 221-312-5;BDBM50570515;Bis(diisobutylthiocarbamoyl) disulfide;AKOS016036659

Chemical Property of Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), tetrakis(2-methylpropyl)-

Chemical Property:

• Appearance/Colour: Light yellow crystal grain
• Vapor Pressure: 9.5E-09mmHg at 25°C
• Melting Point: 73.5-74.5 °C
• Refractive Index: 1.563
• Boiling Point: 462.9 °C at 760 mmHg
• PKA: 0.90±0.50(Predicted)
• Flash Point: 233.7 °C
• PSA: 144.04000
• Density: 1.076 g/cm³
• LogP: 4.21060
• Water Solubility.: 48.8μg/L at 20℃
• XLogP3: 7.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 408.17613385
• Heavy Atom Count: 24
• Complexity: 325

Purity/Quality:

99% ^*data from raw suppliers

IsobutylThiuramDisulfide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CN(CC(C)C)C(=S)SSC(=S)N(CC(C)C)CC(C)C
• Uses: Isobutyl Thiuram Disulfide is an effective curing agent for acrylonitrile-butadiene rubber (NBR) only in the presence of ZnO and stearic acid as curing activators. Also, it is derived from Diisobutylamine (D446538), which is a reagent used in organic synthesis including the preparation of bx7 inhibitors which may be useful in the treatment of certain cancers. Isobutyl Thiuram Disulfide is an effective curing agent for acrylonitrile-butadiene rubber (NBR) only in the presence of ZnO and stearic acid as curing activators.Also, it is derived from Diisobutylamine (D446538), which is a reagent used in organic synthesis including the preparation of bx7 inhibitors which may be useful in the treatment of certain cancers.

Technology Process of Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), tetrakis(2-methylpropyl)-

There total 6 articles about Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), tetrakis(2-methylpropyl)- 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: 98.3%

carbon disulfide (75-15-0,12122-00-8) + diisobutylamine (110-96-3) → tetra(isobutyl)thiuram disulfide (3064-73-1)

Guidance literature:

With oxygen; In isopropyl alcohol; at 50 ℃; for 1h; under 1275.13 Torr; Autoclave;

DOI:10.1080/00397910903537331

Reference yield:

Diisobutyl dithiocarbamate (7283-77-4) → tetra(isobutyl)thiuram disulfide (3064-73-1)

Guidance literature:

With dihydrogen peroxide; at 50 ℃; for 6h; Temperature;

Reference yield:

diisobutylcarbodithioic acid sodium salt (2219-18-3) → tetra(isobutyl)thiuram disulfide (3064-73-1)

Guidance literature:

With sulfuric acid; dihydrogen peroxide;

upstream raw materials:

carbon disulfide

diisobutylamine

Diisobutyl dithiocarbamate

diisobutylcarbodithioic acid sodium salt

Downstream raw materials:

diisobutylcarbamic acid chloride

Refernces

• 1、 Fontenot, Patricia R.,Shan, Bing,Wang, Bo,Simpson, Spenser,Ragunathan, Gayathri,Greene, Angelique F.,Obanda, Antony,Hunt, Leigh Anna,Hammer, Nathan I.,Webster, Charles Edwin,Mague, Joel T.,Schmehl, Russell H.,Donahue, James P.. "Photocatalytic H2-Evolution by Homogeneous Molybdenum Sulfide Clusters Supported by Dithiocarbamate Ligands". . p. 16458 - 16474. Retrieved 2019/12/24.
• 2、 Wang, Meishuang,Song, Xianghai,Ma, Ning. "Reduced graphene oxide as recyclable catalyst for synthesis of Bis(aminothiocarbonyl)disulfides from secondary amines and carbon disulfide". . p. 1233 - 1239. Retrieved 2014/07/21.