ChemicalBook--->CAS DataBase List--->4979-32-2

4979-32-2

4979-32-2 Structure

4979-32-2 Structure
IdentificationMore
[Name]

N,N-Dicyclohexyl-2-benzothiazolsulfene amide
[CAS]

4979-32-2
[Synonyms]

CBI-BB ZERO/001988
DCBS
N,N-DICYCLOHEXYL-2-BENZOTHIAZOLESULFENAMIDE
N,N-DICYCLOHEXYL-2-BENZOTHIAZOLE SULPHENAMIDE
n,n-dicyclohexyl-2-benzothiazolsulfene amide
N,N-Dicyclohexylbenzothiazole-2-sulfenamide
SANTOCURE(R) DCBS
AcceleratorDZ
m181
meramiddch
n,n-dicyclohexyl-2-benzothiazolesulfenamid
N,N-Dicyclohexyl-2-benzothiazolylsulfonamide
n,n-dicyclohexylbenzothiazole-2-sulphenamide
n,n-dicyklohexylbenzthiazolsulfenamid
rhodifax30
soxinoldz
sulfenamiddc
vulkacitdz
N,N-Dicyclohexyl-2-benzothiazolesulfonamide
N,N-dicyclohexy-2-benzothiazolesulphenamide
[EINECS(EC#)]

225-625-8
[Molecular Formula]

C19H26N2S2
[MDL Number]

MFCD00236063
[Molecular Weight]

346.55
[MOL File]

4979-32-2.mol
Chemical PropertiesBack Directory
[Melting point ]

104℃
[Boiling point ]

230°C (rough estimate)
[density ]

1.20
[vapor pressure ]

0Pa at 25℃
[refractive index ]

1.5800 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Acetone (Slightly), Acetonitrile (Slightly), DMSO (Slightly)
[form ]

Solid
[pka]

0.43±0.20(Predicted)
[color ]

Pale Yellow to Light Yellow
[Water Solubility ]

1.9μg/L at 25℃
[Contact allergens]

This substance is a rubber accelerator of the mercapto- benzothiazole-sulfenamide group.
[LogP]

5.95
[CAS DataBase Reference]

4979-32-2(CAS DataBase Reference)
[EPA Substance Registry System]

4979-32-2(EPA Substance)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sodium hydroxide-->Sulfuric acid-->Sodium chloride-->Isopropyl alcohol-->Aniline-->Sodium hypochlorite-->2-Mercaptobenzothiazole-->Dicyclohexylamine-->Sodium mercaptobenzothiazole-->Cyclohexylamine
Safety DataBack Directory
[TSCA ]

TSCA listed
Hazard InformationBack Directory
[Uses]

N,N-Dicyclohexyl-2-benzothiazolesulfenamide is a compound with reproductive and developmental toxicity that can affect body weight gain, reproductive organ weight, and multiple reproductive and developmental indicators in rats.
[Flammability and Explosibility]

Notclassified
[Synthesis]

2-Mercaptobenzothiazole

149-30-4

Dicyclohexylamine

101-83-7

N,N-Dicyclohexyl-2-benzothiazolsulfene amide

4979-32-2

(1) Preparation of M-Na salt solution: mix 400g 2-mercaptobenzothiazole (MBT) with 360g 32wt% sodium hydroxide (NaOH) solution, stirring at 50 ℃ for 2 hours, to get the M-Na salt solution; Preparation of dicyclohexylamine hydrochloride solution: mix 567g of dicyclohexylamine with 376g of 31wt% industrial hydrochloric acid, add 567g of water, stirring at 35 ℃. The solution of dicyclohexylamine hydrochloride was obtained. (2) M-Na salt solution (flow rate of 69 mL/min), dicyclohexylamine hydrochloride solution (flow rate of 136 mL/min), toluene (flow rate of 130 mL/min) and sodium hypochlorite solution with 17% effective chlorine (flow rate of 49 mL/min) were continuously pumped into a microchannel reactor to carry out oxidation reaction. The reaction conditions were: residence time of 2 s, reaction temperature of 30°C, and four microchannel reactors in series were used, each with a volume of 3 mL and a total volume of 12.8 mL.(3) The reactor effluent material was collected, stirred and cooled to 5°C for crystallization. The crude product was washed sequentially twice each with 200 mL of isopropanol and 200 mL of water to obtain S-(benzo[d]thiazol-2-yl)-N,N-dicyclohexylmercaptoamine (DCBS) wet product. After drying, DCBS was obtained as a finished product with 96.2% yield (based on MBT content), 99.2 wt% purity, and a light yellow powder appearance. After recovery of isopropanol from continuous distillation effluent, the residual COD was 5900 ppm.

[References]

[1] Evaluation of reproductive and developmental toxicity of the rubber accelerator N,N-dicyclohexyl-2-benzothiazolesulfenamide in rats DOI:10.1111/j.1741-4520.2007.00161.x
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