기본 정보
- 표준 SMILES
CC(C)(C)NSc1nc2ccccc2s1- InChIKey
IUJLOAKJZQBENM-UHFFFAOYSA-N- 분자식
- C11H14N2S2
- 평균 분자량
- 238.4 g/mol
- 단동위원소 질량
- 238.05984045
개요
rubber accelerator
이름 및 식별자
- 우선 이름
- N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide
- IUPAC
- N-(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropan-2-amine
- 현지명
- N-tert-부틸-2-벤조티아조릴 설펜아미드
- 영어명
- N-tert-Butyl-2-benzothiazolesulfenamide
- 분자식
- C11H14N2S2
- 분자량
- 238.37
이름 및 동의어
N-tert-Butyl-2-benzothiazolesulfenamide95-31-8Nocceler NSVulkacit NZPennac TbbsAccel BNS2-(TERT-BUTYLAMINOTHIO)BENZOTHIAZOLEVanax NS2-Benzothiazolesulfenamide, N-(1,1-dimethylethyl)-2-Benzothiazolesulfenamide, N-tert-butyl-Benzothiazolyl-2-tert-butylsulfenamideN-tert-Butyl-2-benzothiazylsulfenamide
이름 더 보기
N-(1,1-다이메틸에틸)-2-벤조티아졸술폰아마이드N-tert-부틸-2-벤조티아조릴설펜아미드N-tert-부틸-2-벤조티아졸술펜아미드TBBSBBTSNTBBTSaccelbnsDelac NSSoxinolNSpennactbbs
Santocure NS vulcanization acceleratorDTXSID7026572N-tert-Butyl-2-benzothiazolyl sulfenamideW468IFJ99CNSC-84176DTXCID506572RefChem:823300N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide
데이터베이스 식별자
- CAS
95-31-8- PubChem CID
- 7230
- DTXSID
DTXSID7026572- ChEMBL
CHEMBL3182037- UNII
- W468IFJ99C
- EC Number
- 202-409-1
- Nikkaji
- J21.264D
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 78.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 215
실험 및 물리화학적 성질
PolymersPlastics & Rubber -> Rubber Additives
Density1.29 @ 25 °C
Color/FormLIGHT BUFF POWDER OR FLAKES; SOMETIMES COLORED BLUE
SolubilitySOL IN MOST ORG SOLVENTS
Melting Point104 °C (MIN)
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description
Dry Powder; Large Crystals; Large Crystals; Dry Powder; Other Solid
Light beige solid; Sometimes blue; [HSDB] Light buff to tan powder; [MSDSonline]
물리화학적 성질
- 녹는점
- 105 °C · 105°C
- 끓는 점
- 344.1 · 344.1±25.0 °C(Predicted)
- 밀도
- 1 · 1,29 g/cm3
- 증기압
- 0 Pa · 0Pa at 25℃
- 굴절률
- 1.55 · 1.5500 (estimate)
- 인화점
- 165 °C · 165°C
- 저장 조건
- Keep in dark place,Sealed in dry,Room Temperature
- 산도 계수 (pKa)
- 1.25 · 1.25±0.70(Predicted)
- 수용성
- 1.74 mg/L · 1.74mg/L at 20℃
- BRN
- 158370 · 158370
- 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
- SMILES
- S1C2=CC=CC=C2N=C1SNC(C)(C)C
- LogP
- 3.36 at · 3.36 at 25℃
- NIST
- 2 · 2-Benzothiazolesulfenamide, n-(1,1-dimethylethyl)-(95-31-8)
- EPA
- -2 · N-tert-Butyl-2-benzothiazolesulfenamide (95-31-8)
안전 및 규제
GHS 분류
GHS Classification
Warning
H317 (99.6%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 244 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
유해성 정보
Regulatory Information
Chemical: 2-Benzothiazolesulfenamide, N-(1,1-dimethylethyl)-
2-Benzothiazolesulfenamide, N-(1,1-dimethylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Benzothiazolesulfenamide, N-(1,1-dimethylethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: N-tert-butylbenzothiazole-2-sulphenamide (EC: 202-409-1)
N-tert-butyl-2-benzothiazolesulfenamide: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 2-Benzothiazolesulfenamide, N-(1,1-dimethylethyl)-: Human health tier I assessment
Hazards Summary
High dose oral studies with rats showed effects on the liver, kidneys, and erythrocytes (hemolysis); The LOAEL for anemia was 40 mg/kg/day by gavage; Mild irritation to skin and eyes was observed in rabbit studies; A product of hydrolysis, mercaptobenzothiazole, is a potent skin sensitizer; [eChemPortal: SIDSUNEP] A mild irritant; May cause skin sensitization; [MSDSonline] See Mercaptobenzothiazole.
Hazard Classes and Categories
Skin Sens. 1A (99.6%)
Skin sensitization - Category 1
Skin sensitization - Category 1
안전 및 보호
Disposal Methods
SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
독성 정보
Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
안전 데이터
- tsca
- TSCA listed
- rtecs
- DL6200000
- ridadr
- 3077
- HS 번호
- 29342000
- risk_code
- 43-53
- safety_code
- 36-45-61-37-24
- 포장분류
- III
- 위험 등급
- 9
- 기존화학 물질
- KE-11372
- 유해 물질 데이터
- 95-31-8(Hazardous Substances Data)
화학 및 산업
용도 및 제조
Uses
Used as an accelerator for natural and synthetic isoprene rubbers and butadiene rubbers; [HSDB]
RUBBER ACCELERATOR
ACCELERATOR FOR NATURAL & SYNTHETIC ISOPRENE RUBBERS
ACCELERATOR FOR BUTADIENE RUBBERS, EG, STYRENE-BUTADIENE
U.S. Imports(1979) 5.40X10+7 GRAMS (PRINCPL CUSTMS DISTS)
U.S. Production
2023: 7,000,000 - <8,500,000 lb
(1979) PROBABLY GREATER THAN 1.36X10+6 GRAMS
(1981) PROBABLY GREATER THAN 9.08X10+5 GRAMS
>45,000 kg in 1977
Consumer UsesPolymerization promoter
Industry UsesOther
Methods of ManufacturingOXIDATIVE COUPLING OF 2-MERCAPTOBENZOTHIAZOLE & T-BUTYLAMINE USING EITHER SODIUM HYPOCHLORITE OR CHLORINE GAS & AIR
General Manufacturing Information
Rubber Product Manufacturing
2-Benzothiazolesulfenamide, N-(1,1-dimethylethyl)-: ACTIVE
응용 분야
개요N-tert-Butyl-2-benzothiazolesulfenamide (TBBS) is one of the essential kinds of sulfenamide vulcanization accelerator, have anti-incipient scorch and the large advantage of vulcanization rate fast two concurrently for natural rubber, styrene-butadiene rubber(SBR), cis-1,4-polybutadiene rubber, in polyisoprene rubber, be particularly useful for the furnace treated black sizing material that alkalescence is higher, variable color and pollution are slight, the alternative NOBS(N-morpholinyl benzothiaolesulfenamide having carinogenicity possible containing secondary amine), the NOBS of tire industry is replaced with CBS (CZ) or TBBS in l994 law-making stipulation by Germany.
용도N-tert-Butyl-2-benzothiazolesulfenamide is used as an accelerator for natural and synthetic isoprene and butadiene rubbers.
상·하류 제품 정보
상류 원료
공급사50 곳
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
越林试剂021-62960152 · [email protected]
烟台东方化学有限公司+86 532 68629711 137 8060 5697 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
上海永叶生物科技有限公司86-021-61559134 15921386130 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
潍坊市前进精细化工有限公司18753684562 · [email protected]
康迪斯化工(湖北)有限公司13343438265 · [email protected]
武汉鑫儒化工有限公司15927387915 15337108568
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
武汉欣扬瑞和化学科技有限公司13720181483 13720181483 · [email protected]
上海玻尔化学试剂有限公司19102157732 · [email protected]
上海珈得尔化学技术有限公司021-4007787-550 400-7787-550 · [email protected]
成都润泽本土化工有限公司028-88469284 18000562381 · [email protected]
南京择优新材料科技有限公司173-40521416 17340521416 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海西格生物科技有限公司021-57810052 18930344717 · [email protected]
武汉克米克生物医药技术有限公司027-13163388153 13163388153 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
武汉卡诺斯科技有限公司18064039730 · [email protected]
泰安市嘉叶生物科技有限公司15318151873;13127280945 · [email protected]
上海达瑞精细化学品有限公司13816046603 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
佛山晟熠生物科技有限公司18064670521 · [email protected]
武汉弘德悦欣医药科技有限公司027-83850116 18164090116 · [email protected]
陕西缔都医药化工有限公司029-81154043 17391733319 · [email protected]
上海永祉化工科技有限公司021-60944093 18516153908 13917602471 · [email protected]
珠海嘉亿生物科技有限公司18578209868 2355327026 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
济南达恩医药科技有限公司0531-68657833 15553112864 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
관련 반응
1건
연결된 노트
불러오는 중…