수산화 트리메틸벤질암모늄
Benzyltrimethylammonium hydroxide
기본 정보
- CAS
100-85-6- 표준 SMILES
C[N+](C)(C)Cc1ccccc1.[OH-]- InChIKey
NDKBVBUGCNGSJJ-UHFFFAOYSA-M- 분자식
- C10H16N.HO
- 평균 분자량
- 167.25 g/mol
- 단동위원소 질량
- 167.13101416
이름 및 식별자
- 우선 이름
- Benzyltrimethylammonium hydroxide
- IUPAC
- benzyl(trimethyl)azanium hydroxide
- 현지명
- 수산화 트리메틸벤질암모늄
- 영어명
- Benzyltrimethylammonium hydroxide
- 분자식
- C10H17NO
- 분자량
- 167.25
이름 및 동의어
Benzyltrimethylammonium hydroxide100-85-6Triton BTrimethylbenzylammonium hydroxideBenzyl trimethyl ammonium hydroxideSumquat 2311Trimethyl benzylammonium hydroxideBenzenemethanaminium, N,N,N-trimethyl-, hydroxide (1:1)Benzyltrimetylammonium hydroxideN,N,N-Trimethylbenzenemethanaminium hydroxideDTXSID3044332Ammonium, benzyltrimethyl-, hydroxide
이름 더 보기
벤질트리메틸암모늄수산화물벤질트리메틸암모늄하이드록사이드수산화트리메틸벤질암모늄벤질트리메틸암모늄수산화물N-benzyl-trimethylammonium hydroxideBenzyltrimethylammonium hydroxide solutionTRITON(R) Bbenzyltrimethyl-ammoniuhydroxidesumquat2311Triton(rg BPhCH2NMe3(OH)
Benzenemethanaminium, N,N,N-trimethyl-, hydroxideNSC-261034BTMAH 408P4488425WDTXCID1024332RefChem:119016202-895-5N,N,N-Trimethyl-1-phenylmethanaminium hydroxide
데이터베이스 식별자
- CAS
100-85-6- PubChem CID
- 66854
- DTXSID
DTXSID3044332- ChEMBL
CHEMBL3188269- UNII
- 8P4488425W
- EC Number
- 202-895-5
물성
구조 계산 물성
- 극성 표면적
- 1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 107
실험 및 물리화학적 성질
Chemical ClassesNitrogen Compounds -> Quaternary Amines
Physical Description
Liquid
Clear to light yellow liquid with an amine odor; Miscible in water; [MSDSonline]
물리화학적 성질
- 녹는점
- -98 °C · -98 °C
- 끓는 점
- 65 °C/1013 · 65 °C/1013 hPa
- 밀도
- 0.95 g/mL · 0.95 g/mL
- 증기압
- 0 Pa · 0Pa at 25℃
- 굴절률
- 20 · n 20/D 1.43
- 인화점
- 15 °C · 15 °C
- 저장 조건
- 30 °C · Store below +30°C.
- 용해도
- 알코올, 탄화수소, 방향족 탄화수소 및 할로겐화 용매와 혼합 가능합니다.
- 물리적 상태
- clear Liquid
- 색상
- slightly yellow
- 수소이온지수(pH)
- 12 · 12 (20°C in H2O, undiluted)
- 폭발한계
- 5.5 · 5.50-36.50%
- 수용성
- 물, 탄화수소, 방향족 탄화수소 및 할로겐화 용매와 혼합 가능합니다.
- BRN
- 3917256 · 3917256
- InChI
- 1S/C10H16N.H2O/c1-11(2,3)9-10-7-5-4-6-8-10;/h4-8H,9H2,1-3H3;1H2/q+1;/p-1
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 0.3% (1 of 325) of reports.
Danger
H224 (12.6%): Extremely flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 325 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Benzenemethanaminium, N,N,N-trimethyl-, hydroxide
Benzenemethanaminium, N,N,N-trimethyl-, hydroxide (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenemethanaminium, N,N,N-trimethyl-, hydroxide (1:1) 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)
Status: Active Update: 15-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/29507
Benzyltrimethylammonium hydroxide: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryCorrosive; [MSDSonline]
Hazard Classes and CategoriesFlam. Liq. 1 (12.6%)
독성 정보
Adverse EffectsDermatotoxin - Skin burns.
안전 데이터
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.
Agents that modify interfacial tension of water; usually substances that have one lipophilic and one hydrophilic group in the molecule; includes soaps, detergents, emulsifiers, dispersing and wetting agents, and several groups of antiseptics.
용도 및 제조
U.S. Production2023: 50,000 - <250,000 lb
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information
Wholesale and Retail Trade
Benzenemethanaminium, N,N,N-trimethyl-, hydroxide (1:1): ACTIVE
응용 분야
용도Benzyltrimethylammonium hydroxide is used as a phase-transfer catalyst. It is also used in aldol condensation reactions and base-catalyzed dehydration reactions. Further, it serves as a strong organic base and used in Horner-Wadsworth-Emmons olefination reactions. In addition, it is an active component in the formulation, which is used in silicon wafer cleaning applications.
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