기본 정보
- CAS
95-33-0- 표준 SMILES
c1ccc2sc(SNC3CCCCC3)nc2c1- InChIKey
DEQZTKGFXNUBJL-UHFFFAOYSA-N- 분자식
- C13H16N2S2
- 평균 분자량
- 264.4 g/mol
- 단동위원소 질량
- 264.07549087
개요
Thiohexam is a rubber cure accelerator. It is also a known allergen and dermatological sensitizer. Sensitivity to Thiohexam may be identified with a clinical patch test.
이름 및 식별자
- 우선 이름
- Accelerator CZ
- IUPAC
- N-(1,3-benzothiazol-2-ylsulfanyl)cyclohexanamine
- 현지명
- N-사이클로헥셀-벤조티아조릴 설펜아미드
- 영어명
- N-Cyclohexyl-2-benzothiazolesulfenamide
- 분자식
- C13H16N2S2
- 분자량
- 264.41
이름 및 동의어
95-33-0ThiohexamVulkacit CZSantocureSulfenaxSulfenamide TsAccelerator CZCuraxDuraxSantocure PowderSulfenax TsBVulkacite CZ
이름 더 보기
N-사이클로헥셀-벤조티아조릴설펜아미드N-사이클로헥실벤조티아졸-2-술펜아마이드N-시클로헥실벤조티아졸-2-술펜아미드벤조티아질-2-사이클로헥실술펜산2-벤젠티아졸레설페나미드, N-사이클로헥실-N-사이클로헥실벤조티아졸-2-설페나미드벤조티아질-2-사이클로헥실설페나미드N-사이클로헥실-2-벤조티아졸설펜아미드CBSC13H16N2S2Accelerator CBSn-cyclohexylbenzothiazole-2-sulfenamideN-Cyclohexyl-2-benzothiazolylsulfenamide, SANTOCURE CBSHIP4
Vulkacit cz/cVulkacit cz/kSulfenax CBSantocure PelletsVulcafor CBSConac AConac SDelac S
데이터베이스 식별자
- CAS
95-33-0- PubChem CID
- 7232
- DTXSID
DTXSID5020360
물성
구조 계산 물성
- XLogP
- 4.4
- 극성 표면적
- 78.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 244
실험 및 물리화학적 성질
PolymersPlastics & Rubber -> Rubber Additives
SpringerMaterials PropertiesDiamagnetic susceptibility
Density1.27
Color/FormCREAM-COLORED POWDER
SolubilityINSOL IN WATER; SOL IN BENZENE
Endocrine DisruptorsPotential endocrine disrupting compound
Melting Point93-100 °C
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description
Wet Solid; Other Solid; Dry Powder; Large Crystals
Cream-colored solid; [HSDB] Off-white powder or white to off-white granules; [MSDSonline]
물리화학적 성질
- 녹는점
- 93 · 93-100°C
- 끓는 점
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H317: 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)
Warning
H317 (100%): 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)
유해성 정보
Regulatory Information
Chemical: 2-Benzothiazolesulfenamide, N-cyclohexyl-
2-Benzothiazolesulfenamide, N-cyclohexyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Benzothiazolesulfenamide, N-cyclohexyl- 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-cyclohexylbenzothiazole-2-sulfenamide (EC: 202-411-2)
Thiohexam: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 2-Benzothiazolesulfenamide, N-cyclohexyl-: Human health tier I assessment
Hazards Summary
May cause skin sensitization; [eChemPortal: ESIS] An irritant; May cause skin and respiratory sensitization after prolonged contact; [MSDSonline] Sensitization has been reported in metal workers, homemakers, health services, laboratories, and building industries; [Kanerva, p. 1775] Danger of skin sensitization; [MAK] See Mercapto mix.
Special ReportsScansetti G; Ergonomics and Health in Modern Offices. Grandjean E (ed), Taylor & Francis (1984). Toxic agents emitted from office machines and materials.
Hazard Classes and Categories
화학 및 산업
약리 정보
FDA Pharmacological Classification
UCA53G94EV
N-CYCLOHEXYL-2-BENZOTHIAZOSULFENAMIDE
Established Pharmacologic Class [EPC] - Standardized Chemical Allergen
Physiologic Effects [PE] - Increased Histamine Release
Physiologic Effects [PE] - Cell-mediated Immunity
Chemical Structure [CS] - Allergens
용도 및 제조
Uses
Used as accelerator for rubber vulcanization; [HSDB]
Metal Machining [Category: Heat or Machine]
ACCELERATOR FOR RUBBER VULCANIZATION
U.S. Exports
(1972) No Data
(1975) No Data
U.S. Imports
(1972) No Data
(1975) 8.41X10+6 GRAMS (PRINCPL CUSTMS DISTS)
U.S. Production
2023: 10,000,000 - <25,000,000 lb
(1972) 4.00X10+9 GRAMS
(1975) 1.15X10+9 GRAMS
Consumption PatternsESSENTIALLY 100% AS RUBBER ACCELERATOR
Consumer UsesPolymerization promoter
Industry UsesCatalyst
Methods of ManufacturingREACTION OF 2-BENZOTHIAZOLESULFENYL CHLORIDE WITH CYCLOHEXYLAMINE
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
2-Benzothiazolesulfenamide, N-cyclohexyl-: ACTIVE
관련 반응
2건
화합물 노트
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