ChemicalBook--->CAS DataBase List--->96-69-5

96-69-5

96-69-5 Structure

96-69-5 Structure
IdentificationMore
[Name]

4,4'-Thiobis(6-tert-butyl-m-cresol)
[CAS]

96-69-5
[Synonyms]

1,1'-Thiobis(2-methyl-4-hydroxy-5-tert-butylbenzene)
2,2'-DI-TERT-BUTYL-5,5'-DIMETHYL-4,4'-THIODIPHENOL
4,4'-THIOBIS(2-T-BUTYL-5-METHYLPHENOL)
4,4'-THIOBIS(2-TERT-BUTYL-5-METHYLPHENOL)
4,4'-Thiobis(3-methyl-6-tert-butylphenol)
4,4'-THIO-BIS-(6-T-BUTYL-3-METHYLPHENOL)
4,4'-THIOBIS(6-TERT-BUTYL-M-CRESOL)
4,4-THIOBIS(6-TERT-BUTYL-M-CRESOL)
5-TERT-BUTYL-4-HYDROXY-2-METHYLPHENYL SULFIDE
BIS(3-TERT-BUTYL-4-HYDROXY-6-METHYLPHENYL)-SULFIDE
BIS(5-TERT-BUTYL-4-HYDROXY-2-METHYLPHENYL) SULFIDE
SANTONOX(R)
SANTONOX(R) R
SANTOWHITE CRYSTALS
3-tert-Butyl-4-hydroxy-6-methylphenyl sulfide
4,4’-thiobis(2-(1,1-dimethylethyl)-5-methyl-pheno
4,4’-thiobis(2-(1,1-dimethylethyl)-5-methylphenol)
4,4’-thiobis(6-tert-butyl-3-cresol
4,4’-thiobis(6-tert-butyl-3-methylphenol)
4,4’-thiobis(6-tert-butyl-m-creso
[EINECS(EC#)]

202-525-2
[Molecular Formula]

C22H30O2S
[MDL Number]

MFCD00026287
[Molecular Weight]

358.54
[MOL File]

96-69-5.mol
Chemical PropertiesBack Directory
[Appearance]

4,40-Thiobis(6-tert-butyl-m-cresol) is a light gray to tan powder. Aromatic odor.
[Melting point ]

160-165 °C
[Boiling point ]

460.94°C (rough estimate)
[density ]

1.06~1.12g/cm3
[vapor pressure ]

0.001Pa@20°C
[refractive index ]

1.5200 (estimate)
[Fp ]

215 °C
[storage temp. ]

Store below +30°C.
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Fine white to gray powder.
[pka]

10.76±0.36(Predicted)
[color ]

White to Off-White
[Water Solubility ]

<0.01 g/100 mL at 18 ºC
[Stability:]

Stable under recommended storage conditions., Stable Under Recommended Storage C
[InChIKey]

HXIQYSLFEXIOAV-UHFFFAOYSA-N
[LogP]

5.24 at 25℃
[Uses]

Protection of light-colored rubber from oxidation and of nonstaining neoprene compounds against deterioration.
[CAS DataBase Reference]

96-69-5(CAS DataBase Reference)
[NIST Chemistry Reference]

4,4'-Thiobis(3-methyl-6-t-butylphenol)(96-69-5)
[EPA Substance Registry System]

96-69-5(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

WGK 2 water endangering
[RTECS ]

GP3150000
[Autoignition Temperature]

402 °C
[HS Code ]

29309070
[Safety Profile]

Poison by intraperitoneal route and probably by ingestion and inhalation. Mutation data reported. See also SULFIDES. When heated to decomposition it emits highly toxic fumes of SOx.
[Hazardous Substances Data]

96-69-5(Hazardous Substances Data)
[Toxicity]

LD50 orally in Rabbit: 2345 mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Chlorine-->Sulfur-->Isobutylene-->m-Cresol-->6-tert-Butyl-m-cresol
Hazard InformationBack Directory
[General Description]

White or light gray to tan powder.
[Reactivity Profile]

4,4'-THIOBIS(6-TERT-BUTYL-M-CRESOL)(96-69-5) may be sensitive to light.
[Air & Water Reactions]

Sensitive to base hydrolysis and may spontaneously oxidize in solution. . Insoluble in water.
[Potential Exposure]

This material is used as an antioxidant in the plastics and rubber industries; in Neoprene and other synthetic rubbers; in polyethylene and polypropylene.
[Fire Hazard]

This chemical is combustible.
[First aid]

Skin Contact: Flood all areas of body that have contacted the substance with water. Don’t wait to remove contaminated clothing; do it under the water stream. Use soap to help assure removal. Isolate contaminated clothing when removed to prevent contact by others. Eye Contact: Remove any contact lenses at once. Flush eyes well with copious quantities of water or normal saline for at least 2030 minutes. Seek medical attention. Inhalation: Leave contaminated area immediately; breathefresh air. Proper respiratory protection must be supplied to any rescuers. IF coughing, difficult breathing or any other symptoms develop, seek medical attention at once, even if symptoms develop many hours after exposure. Ingestion: If convulsions are not present, give a glass or two of water or milk to dilute the substance. Assure that the person’s airway is unobstructed and contact hospital or poison center immediately for advice on whether or not to induce vomiting.
[Incompatibilities]

Incompatible with oxidizers (chlorates, nitrates, peroxides, permanganates, perchlorates, chlorine, bromine, fluorine, etc.); contact may cause fires or explosions. Keep away from alkaline materials, strong bases, strong acids, oxoacids, epoxides. May evolve explosive hydrogen sulfide upon contact with moisture or acids.
[Chemical Properties]

4,40-Thiobis(6-tert-butyl-m-cresol) is a light gray to tan powder. Aromatic odor.
[Chemical Properties]

white to almost white crystals or crystalline
[Hazard]

Toxic by inhalation. Upper respiratory tract irritant. Questionable carcinogen.
[Health Hazard]

4,4'-Thiobis(6-tert-butyl-mcresol) (TBBC) is of low systemic toxicity in animals; allergic contact dermatitis has been reported in humans.
[Flammability and Explosibility]

Nonflammable(100%)
[Carcinogenicity]

TBBC was not mutagenic in Salmonella typhimurium strains with or without metabolic activation. In Chinese hamster ovary cells, TBBC induced an increase in sister chromatid exchanges but there were no increases in chromosomal aberrations.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,1'-Thiobis(2-methyl-4-hydroxy-5-tert-butylbenzene)(96-69-5).msds
Spectrum DetailBack Directory
[Spectrum Detail]

4,4'-Thiobis(6-tert-butyl-m-cresol)(96-69-5)MS
4,4'-Thiobis(6-tert-butyl-m-cresol)(96-69-5)1HNMR
4,4'-Thiobis(6-tert-butyl-m-cresol)(96-69-5)13CNMR
4,4'-Thiobis(6-tert-butyl-m-cresol)(96-69-5)IR1
4,4'-Thiobis(6-tert-butyl-m-cresol)(96-69-5)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

5-tert-Butyl-4-hydroxy-2-methylphenyl sulfide, 96%(96-69-5)
[Sigma Aldrich]

96-69-5(sigmaaldrich)
[TCI AMERICA]

4,4'-Thiobis(6-tert-butyl-m-cresol),>98.0%(GC)(96-69-5)
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