N-tert-Butyl-2-benzothiazolesulfenamide

Basic Information

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CAS Number

95-31-8

Molecular Formula

C11H14N2S2

Molecular Weight

238.38 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

105 ºC

Boiling Point

344.1ºC at 760 mmHg

Density

1.29

Flash Point

165°C

Refractive Index

1.5500 (estimate)

SMILES

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CC(C)(C)NSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C11H14N2S2/c1-11(2,3)13-15-10-12-8-6-4-5-7-9(8)14-10/h4-7,13H,1-3H3

InChIKey

IUJLOAKJZQBENM-UHFFFAOYSA-N

LogP

3.6915000000000022

Topological Polar Surface Area

24.92 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

215

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 9 Class 9

Synonyms & References

English

S-(Benzo[d]thiazol-2-yl)-N-(tert-butyl)thiohydroxylamine
TBBS
n-tert-butyl-2-benzothiazolesulphenamide
accelerator ns
2-(tert-butylaminothio)benzothiazole
n-tertiarybutyl-2-benzothiazole sulfennamide
2-[(tert-butylamino)sulfanyl]-1,3-benzothiazole
2-benzothiazolesulfenamide, n-tert-butyl-
accel bns
accelerator(ns)
akrochem bbts
bbts
benzothiazolesulfenamide, n-(1,1-dimethylethyl)-
benzothiazolyl-2-tert-butylsulfenamide
butyl 2-benzothiazole sulfenamide
butylbenzothiazole sulfenamide
conacns,(dupont)
delac ns
n-(1,1-dimethylethyl)-2-benzothiazolesulfenamid
n-(1,1-dimethylethyl)-2-benzothiazolesulfenamide
n-(1,1-dimethylethyl)-benzothiazolesulfenamid
n-(1,1-dimethylethyl)benzothiazolesulfenamide
n-t-butyl-2-benzothioazole sulfenamide
Accelerator BBTS
N-(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropan-2-amine
N-t-Butyl-2-benzothiazolesulfenamide
N-TERT-BUTYL-2-BENZOTHIAZOLESULFENAMIDE
S-(Benzo[d]thiazol-2-yl)-N-(tert-butyl)-thiohydroxylamine
TBBS（NS）
N-tert-Butylbenzothiazole-2-sulphenamide
NTBBTS

MDL Number

MFCD00022873

FAQ

What is N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8)?

N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8) is a white crystalline solid with the chemical formula C11H13NS2. It belongs to the benzothiazole sulfenamide class, known for its antioxidant properties and stability under various conditions. This compound is commonly used in industrial and pharmaceutical applications due to its reactivity and functional group versatility.

What are the main uses of N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8)?

N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8) is primarily used as an antioxidant in pharmaceuticals and industrial settings, such as rubber and polymer stabilization. It also serves as a synthetic intermediate in research for developing new materials and drug compounds. Its applications are supported by its chemical structure, which enhances functionality in diverse sectors.

Is N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8) safe?

N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8) is generally considered safe when handled properly. It has low acute toxicity but requires standard chemical safety precautions, such as wearing gloves and eye protection. Safety data sheets (SDS) indicate it is non-hazardous under normal conditions, though long-term exposure effects should be minimized with appropriate ventilation and protective measures.

How should N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8) be stored?

N-tert-Butyl-2-benzothiazolesulfenamide (CAS: 95-31-8) should be stored in a cool, dry, and dark place, preferably at 2-8°C. Keep it in airtight, moisture-proof containers to maintain stability and prevent degradation. Avoid exposure to light and air, and ensure storage areas are well-ventilated to comply with safety and preservation standards.