1-Butyl-3-methylimidazolium chloride

HCID 2734161CAS 79917-90-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCCCn1cc[n+](C)c1.[Cl-]
InChIKey
FHDQNOXQSTVAIC-UHFFFAOYSA-M
분자식
C8H15ClN2
평균 분자량
174.67 g/mol
단동위원소 질량
174.09237616

개요

structure in first source

이름 및 식별자

우선 이름
1-Butyl-3-methylimidazolium chloride
IUPAC
1-butyl-3-methylimidazol-3-ium chloride
영어명
1-Butyl-3-methylimidazolium chloride
분자식
C8H15ClN2
분자량
174.67

이름 및 동의어

1-Butyl-3-methylimidazolium chloride79917-90-1BMIMCL1-n-Butyl-3-Methylimidazolium Chloride(Bmim)ClBasionic ST-70DTXSID6031461[bmim]cl3-Butyl-1-methylimidazolium chloride1H-Imidazolium, 3-butyl-1-methyl-, chloride (1:1)41PS77334ADTXCID4011461
이름 더 보기
1-Butyl-3-MethyliMidazoliuM chloride 25GR1-Butyl-3-MethyliMidazoliuM Chloride [BMiM]ClSKL1349SKL1501JACS-79917-90-1Basionics? ST 70BASIONIC(TM) ST 70
RefChem:75261627-110-7(bmim)BrButylmethylimidazolium chloride3-Butyl-1-methyl-1H-imidazol-3-ium chlorideMFCD03095425Butylmethylimidazolium chloride [MI]1-butyl-3-methylimidazol-3-ium;chloride

데이터베이스 식별자

CAS
79917-90-1
PubChem CID
2734161
DTXSID
DTXSID6031461
ChEMBL
CHEMBL3183408
UNII
41PS77334A
EC Number
460-120-8、627-110-7

물성

구조 계산 물성

극성 표면적
8.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
3
무거운 원자 수
11

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Imidazoles
Physical DescriptionSlightly yellow solid; [Merck Index] Colorless or yellowish solid with a solvent odor; [NTP] Light yellow hygroscopic solid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점
70 °C · ~70 °C
밀도
25 · d25 1.08 (dried)
인화점
192 °C · 192 °C
저장 조건
Inert atmosphere,Room Temperature
용해도
DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태
벌크 크리스탈

화학적 성질

cream-colored to yellow mass

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H301 (90.2%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 51 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

유해성 정보

Regulatory InformationREACH registered substance: 3-butyl-1-methyl-1H-imidazol-3-ium chloride (EC: 460-120-8)
Hazards Summary · 1건

Teratogenicity observed in mice orally administered 225 mg/kg/day during organogenesis (maternally toxic); [Shepard's Catalog of Teratogenic Agents] A modified local lymph node assay (LLNA) of mice could not be completed due to high dermal toxicity, causing mortality at 60% (approximately 1,570 mg/kg) and 30% (approximately 815 mg/kg) concentrations; Oral LD50 (rat) = 300-500 mg/kg; [EPA - TSCATS]

Hazard Classes and Categories · 2건

Acute Tox. 3 (100%)

Acute Tox. 3 (90.2%)

안전 데이터

wgk
3
ridadr
UN 2811 6.1/PG 3
HS 번호
29332900
risk_code
25-36/37/38-51/53-36/38
hazard_code
T,N
safety_code
26-45-61-22

화학 및 산업

용도 및 제조

Uses · 2건

Used as a solvent for organic reactions; [Merck Index] Used in anion exchange reactions, as a catalyst or catalyst component, solvent, electrolyte (batteries and metal recovery), in other electrochemical processes, and in chromatographic separations; [NTP]

Battery Manufacturing [Category: Industry]

응용 분야

용도1-Butyl-3-methylimidazolium chloride can be used as a precursor for the preparation of other ionic liquids by anion metathesis.

일반 설명1-Butyl-3-methylimidazolium chloride is an imidazolium based ionic liquid.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

관련 반응

2건
반응 기록 만들기

연결된 노트

불러오는 중…