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3064-73-1

Basic Information
CAS No.: 3064-73-1
Name: Diisobutylthiuram disulfide
Article Data: 9
Molecular Structure:
Molecular Structure of 3064-73-1 (Diisobutylthiuram disulfide)
Formula: C18H36N2S4
Molecular Weight: 408.761
Synonyms: Disulfide,bis(diisobutylthiocarbamoyl) (6CI,7CI,8CI);Thioperoxydicarbonic diamide([(H2N)C(S)]2S2), tetrakis(2-methylpropyl)- (9CI);Bis(diisobutylthiocarbamoyl)disulfide;Isobutyl Tuads;N,N,N',N'-Tetraisobutylthiuramdisulfide;Tetraisobutylthiuram disulfide;
EINECS: 221-312-5
Density: 1.076 g/cm3
Melting Point: 73.5-74.5 °C
Boiling Point: 462.9 °C at 760 mmHg
Flash Point: 233.7 °C
Solubility: 48.8μg/L at 20℃
Appearance: Light yellow crystal grain
PSA: 144.04000
LogP: 4.21060
Synthetic route
75-15-0

carbon disulfide

110-96-3

diisobutylamine

3064-73-1

tetra(isobutyl)thiuram disulfide

Conditions
ConditionsYield
With oxygen In isopropyl alcohol at 50℃; under 1275.13 Torr; for 1h; Autoclave;98.3%
Stage #1: carbon disulfide; diisobutylamine In ethanol at 10 - 50℃; for 1h;
Stage #2: With iodine In ethanol
93%
With triethylamine In ethanol at 20℃; for 14h; Green chemistry;73%
With oxygen; eosin Y disodium salt In methanol under 3750.38 Torr; for 0.333333h; Solvent; Flow reactor; Irradiation; Green chemistry;46%
With methanol; potassium hydroxide; iodine
sodium diisobutyl dithiocarbamate

sodium diisobutyl dithiocarbamate

3064-73-1

tetra(isobutyl)thiuram disulfide

Conditions
ConditionsYield
With hydrogenchloride; methanol; sodium nitrite at 5 - 12℃;
110-96-3

diisobutylamine

3064-73-1

tetra(isobutyl)thiuram disulfide

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: water / 0.5 h / 20 °C
2: dihydrogen peroxide / 6 h / 50 °C
View Scheme
7283-77-4

Diisobutyl dithiocarbamate

3064-73-1

tetra(isobutyl)thiuram disulfide

Conditions
ConditionsYield
With dihydrogen peroxide at 50℃; for 6h; Temperature;
2219-18-3

diisobutylcarbodithioic acid sodium salt

3064-73-1

tetra(isobutyl)thiuram disulfide

Conditions
ConditionsYield
With sulfuric acid; dihydrogen peroxide
3064-73-1

tetra(isobutyl)thiuram disulfide

38952-42-0

diisobutylcarbamic acid chloride

Conditions
ConditionsYield
Stage #1: tetra(isobutyl)thiuram disulfide With chlorine In dichloromethane at 24 - 26℃; for 7.58333h; Cooling with ice;
Stage #2: With water; sodium hydrogencarbonate In dichloromethane Cooling with ice;
87%

tetraselenidotungstate ion

3064-73-1

tetra(isobutyl)thiuram disulfide

139957-26-9

WSe2{N(CH2CH(CH3)2)2C(S)S}3

Conditions
ConditionsYield
In acetonitrile room temp.; recrystn. (CH2Cl2-hexane);79%

tetraethylammonium tetrathioperrhenate

3064-73-1

tetra(isobutyl)thiuram disulfide

Re2(μ-S)2(S2CN(CH2CH(CH3)2)2)4

Conditions
ConditionsYield
In [(2)H6]acetone byproducts: S2CN(i-Bu)2(1-); Ar-atmosphere; treatment of Re-complex with 2.6 equivs. of disulfide (room temp., overnight, pptn.); filtration, washing (ether); elem. anal.; product contaminated with S;50%
In acetonitrile byproducts: sulfur; elem. anal.;

Mo2S4{(C4H9)2NCS2}2

3064-73-1

tetra(isobutyl)thiuram disulfide

Mo4S4{(C4H9)2NCS2}6

Conditions
ConditionsYield
With NaBH4 In N,N-dimethyl-formamide soln. of the Mo-complex and the disulfide combined with a soln. of NaBH4, refluxed for 1 h; chromd. on silica gel with CH2Cl2/hexane (3:1);35%
3064-73-1

tetra(isobutyl)thiuram disulfide

Mo3S13(2-)*2H3N*2H(1+)

7681-82-5

sodium iodide

I(1-)*C27H54Mo3N3S13(1+)

Conditions
ConditionsYield
Stage #1: tetra(isobutyl)thiuram disulfide; Mo3S13(2-)*2H3N*2H(1+) In N,N-dimethyl-formamide for 0.5h;
Stage #2: sodium iodide In ethanol; N,N-dimethyl-formamide at 50℃; for 12h;
30%
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    3064-73-1

    Isobutyl Thiuram Disulfide

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  • tetra(isobutyl)thioperoxydicarbamic acid

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    3064-73-1

    tetra(isobutyl)thioperoxydicarbamic acid

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  • Diisobutylthiuram disulfide

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    3064-73-1

    Diisobutylthiuram disulfide

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  • Thioperoxydicarbonicdiamide ([(H2N)C(S)]2S2), N,N,N',N'-tetrakis(2-methylpropyl)-

  • Casno:

    3064-73-1

    Thioperoxydicarbonicdiamide ([(H2N)C(S)]2S2), N,N,N',N'-tetrakis(2-methylpropyl)-

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    3064-73-1

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  • Diisobutylthiuram disulfide CAS No.3064-73-1

  • Casno:

    3064-73-1

    Diisobutylthiuram disulfide CAS No.3064-73-1

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    Appearance:solid or liquid Storage:sealed in cool and dry place Package:As customer's requested Application:Pharma Intermediate Transportation:by courier/air/sea Port:Any port in China

    Guangdong Juda Chemical Industrial Co.,Limited is a company specializing in APIs,pharmaceutical intermediates, electronic chemicals, plant extracts,fine chemicals and cosmetics raw

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Specification

The IUPAC name of Diisobutylthiuram disulfide is bis(2-methylpropyl)carbamothioylsulfanyl N,N-bis(2-methylpropyl)arbamodithioate . With the CAS registry number 3064-73-1, it is also named as Tetra(isobutyl)thioperoxydicarbamic acid ; Thioperoxydicarbonic diamide (((H2N)C(S))2S2), N,N,N',N'-tetrakis(2-methylpropyl)- ; 1,1',1'',1'''-[Disulfanediylbis(carbonothioylnitrilo)]tetrakis(2-methylpropane) .

The Diisobutylthiuram disulfide is light yellow crystal grain which is soluble in benzene , acetone , dichloroethane , carbon disulfide , toluene , chloroform , slightly soluble in alcohol and ether , and insoluble in gasoline and water. It is used as speed accelerator and does not have the property of rubber dyeing. It is applicable to NR, IR, BR, SBR, NBR and EPDM.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 7.40 ; (2)# of Rule of 5 Violations: 1 ; (3)ACD/LogD (pH 5.5): 7.39 ; (4)ACD/LogD (pH 7.4): 7.39 ; (5)ACD/BCF (pH 5.5): 245565.97 ; (6)ACD/BCF (pH 7.4): 245571.91 ; (7)ACD/KOC (pH 5.5): 251104.31 ; (8)ACD/KOC (pH 7.4): 251110.39 ; (9)#H bond acceptors: 2 ; (10)#H bond donors: 0 ; (11)#Freely Rotating Bonds: 11 ; (12)Index of Refraction: 1.563 ; (13)Molar Refractivity: 123.29 cm3 ; (14)Molar Volume: 379.5 cm3 ; (15)Polarizability: 48.87 10-24cm3 ; (16)Surface Tension: 45 dyne/cm ; (17)Enthalpy of Vaporization: 72.4 kJ/mol ; (18)Vapour Pressure: 9.5E-09 mmHg at 25°C ; (19)Rotatable Bond Count: 11 ; (20)Exact Mass: 408.176132 ; (21)MonoIsotopic Mass: 408.176132 ; (22)Topological Polar Surface Area: 121 ; (23)Heavy Atom Count: 24.

People can use the following data to convert to the molecule structure. SMILES: S=C(SSC(=S)N(CC(C)C)CC(C)C)N(CC(C)C)CC(C)C; InChI:
InChI=1/C18H36N2S4/c1-13(2)9-19(10-14(3)4)17(21)23-24-18(22)20(11-15(5)6)12-16(7)8/h13-16H,9-12H2,1-8H3. Diisobutylthiuram disulfide has many suppliers, such as Hebi Shancheng Kangbo Lianhe Rubber Chemical Plant, Linkwell Rubber Chemicals Co., Ltd., Ningbo BlueHill Chemicals Co., Ltd. and Puyang Willing Chemical Co., Ltd..