Benzyltrimethylammonium methoxide

HCID 8504CAS 122-08-7

기본 정보

표준 SMILES: C[N+](C)(C)Cc1ccccc1.C[O-]
InChIKey: SMTUJUHULKBTBS-UHFFFAOYSA-N
분자식: C11H19NO
평균 분자량: 181.27 g/mol
단동위원소 질량: 181.14666423

이름 및 식별자

우선 이름: Benzyltrimethylammonium methoxide
IUPAC: benzyl(trimethyl)azanium;methanolate
영어명: Benzyltrimethylammonium methoxide
분자식: C11H19NO
분자량: 181.28

이름 및 동의어

Benzyltrimethylammonium methoxide122-08-7Benzyltrimethylammonium methanolateN,N,N-Trimethylbenzenemethanaminium methoxideBenzenemethanaminium, N,N,N-trimethyl-, methoxideAMMONIUM, BENZYLTRIMETHYL-, METHOXIDENSC-221306QT9DB9C7Y6DTXSID5059537Benzenemethanaminium, N,N,N-trimethyl-, salt with methanol (1:1)RefChem:119018DTXCID3033723

이름 더 보기

benzyltrimethyl-ammoniumethoxideBenzyltrimethylaminium·methoxideN-BENZYL-N,N,N-TRIMETHYLAMMONIUM METHOXIDEn,n,n-trimethyl-benzenemethanaminiumethoxideBenzyl trimethylammonium methoxide, 40 wt% soln. in methanolBENZYL TRIMETHYLAMMONIUM METHOXIDE, 40% SOLUTION IN METHANOLBenzyltrimethylammonium methoxide, 40 wt% solution in methanol

204-521-6benzyl(trimethyl)azanium;methanolateEINECS 204-521-6NSC 221306trimethyl benzyl ammonium methoxideAmmonium, methoxidebenzyltrimethylammoniummethoxideSCHEMBL239249

데이터베이스 식별자

CAS: 122-08-7
PubChem CID: 8504
DTXSID: DTXSID5059537
UNII: QT9DB9C7Y6
EC Number: 204-521-6

물성

구조 계산 물성

극성 표면적: 23.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 109

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Quaternary Amines

Physical Description40% Methanol solution: Clear faintly yellow liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

밀도: 0.9 · 0.9
인화점: 11 °C · 11 °C
저장 조건: Flammables area
물리적 상태: 액체
색상: 무색투명~연황색
EPA: Benzenemethanaminium, N,N,N-trimethyl-, methoxide (122-08-7)

화학적 성질

CLEAR COLOURLESS TO LIGHT YELLOW SOLUTION

안전 및 규제

유해성 정보

Hazards Summary · 1건

Intravenous LD50 (mouse) = 5.6 mg/kg; [RTECS] 40% Methanol solution: Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Toxic by ingestion, inhalation, and skin absorption; Risk of serious irreversible adverse health effects; Targets the eye and kidney; [Sigma-Aldrich MSDS] See Methyl alcohol.

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

tsca: TSCA listed
ridadr: 3286
HS 번호: 29239000
risk_code: 39/23/24/25-34-23/24/25-11
hazard_code: T-F,T
safety_code: 7-45-36/37/39-28A-26-16

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

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.