1-Butyl-3-methylimidazolium tetrafluoroborate (HCID 2734178)

이름 및 식별자

우선 이름: 1-Butyl-3-methylimidazolium tetrafluoroborate
IUPAC: 1-Butyl-3-methyl-1H-imidazol-3-ium tetrafluoridoborate(1-)
영어명: 1-Butyl-3-methylimidazolium tetrafluoroborate
분자식: C8H15BF4N2
분자량: 226.02

이름 및 동의어

BMIMBF41-N-BUTYL-3-METHYLIMIDAZOLIUM TETRAFLUOROBORATE3-Butyl-1-Methyl-1H-iMidazol-3-iuM tetrafluoroborate1-Butyl-3-98%MinSKL1400JACS-174501-65-6Basionics? EE 04Basionics(R) EE 041-BUTYL-3-METHYL-IMIDAZOLIUM TETRAFLUORO

데이터베이스 식별자

CAS: 174501-65-6
PubChem CID: 2734178
DTXSID: DTXSID5049231
ChEMBL: CHEMBL3186788
UNII: T2TVZ2306T
EC Number: 638-831-1
Nikkaji: J3.798.242C

물성

구조 계산 물성

극성 표면적: 8.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 3
무거운 원자 수: 15
형식 전하: 0
복잡도: 112

물리화학적 성질

녹는점: -71 °C · -71 °C
밀도: 1.21 g/mL · 1.21 g/mL at 20 °C (lit.)
굴절률: 20 · n20/D 1.52
인화점: 288 °C · 288 °C
저장 조건: 30 °C · Store below +30°C.
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 점성 액체
색상: 맑은 노란색-주황색
수소이온지수(pH): 5 · 5 (H2O, 20℃)
수용성: 아세톤, 아세토니트릴, 에틸 아세테이트, 이소프로필 알코올 및 염화메틸렌과 혼합 가능합니다. 헥산, 톨루엔, 물과 섞이지 않습니다.
안정성: 흡습성
InChI: InChI=1S/C8H15N2.BF4/c1-3-4-5-10-7-6-9(2)8-10;2-1(3,4)5/h6-8H,3-5H2,1-2H3;/q+1;-1
InChIKey: YKVHBSVCYVBXQM-UHFFFAOYSA-M
SMILES: N1(CCCC)C=C[N+](C)=C1.[B-](F)(F)(F)F

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (77%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (97.8%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (20.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H411 (77.7%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

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 139 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (77%)；Skin Irrit. 2 (97.8%)；Eye Irrit. 2 (97.8%)；STOT SE 3 (20.9%)；Aquatic Chronic 2 (77.7%)

안전 데이터

wgk: 3
ridadr: UN2810 6.1/PG 3
HS 번호: 2933 29 90
risk_code: 22-36/37/38-51/53-36/38-25
hazard_code: Xn,Xi,N,T
safety_code: 37/39-26-61-45
포장분류: Ⅲ
위험 등급: 9
F 고인화성물질: 10-21
Hazard Classifications: Acute Tox. 3 OralAquatic Chronic 2Eye Irrit. 2Skin Irrit. 2
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야

용도1-Butyl-3-methylimidazolium tetrafluoroborate may be used as an extractant for the removal of dibenzothiophene (DBS) from liquid fuels via extractive desulfurization.

일반 설명1-Butyl-3-methylimidazolium tetrafluoroborate is a high-purity ionic liquid (HPIL) with low water and halogen content.