비스무트(III)트리플루오로메탄설포네이트

Bi(OTf)3

HCID 9917655

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 88189-03-1
표준 SMILES: O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Bi+3]
InChIKey: NYENCOMLZDQKNH-UHFFFAOYSA-K
분자식: C3BiF9O9S3
평균 분자량: 656.2 g/mol
단동위원소 질량: 655.83647

이름 및 식별자

우선 이름: Bi(OTf)3
IUPAC: bismuth tris(trifluoromethanesulfonate)
현지명: 비스무트(III)트리플루오로메탄설포네이트
영어명: Bismuth(III) trifluoromethanesulfonate
분자식: 3CF3O3S.Bi
분자량: 656.18

이름 및 동의어

Bismuth Trifluoromethanesulfonatebismuth(iii) triflateRefChem:569505Bi(OTf)3Bismuth(III) trifluoromethanesulfonate88189-03-1Bismuth triflatebismuth;trifluoromethanesulfonateBismuth(3+) triflateBismuth triflate [MI]Bismuth tris(trifluoromethanesulfonate)Bismuth(3+) trifluoromethanesulfonate

이름 더 보기

비스무트(III)트리플루오로메탄설포네이트BISMUTH(III)TRIFLATEBISMUTH(III)TRIFLUOROMETHANESULPHONATEBisMuth(Ⅲ) trifluoroMethanesulfonateBismuth(III) trifluoromethanesulfonatTrifluoromethanesulfonicacidbismuthsalt

MFCD02093669UNII-51KD8E1741C3BiF9O9S351KD8E1741Methanesulfonic acid, 1,1,1-trifluoro-, bismuth(3+) salt (3:1)Bismuth(III)trifluoromethanesulfonateBismuth(III) Trifluoromethanesulfonate (3:1)bismuth (III) triflate

데이터베이스 식별자

CAS: 88189-03-1
PubChem CID: 9917655
DTXSID: DTXSID70432758
UNII: 51KD8E1741
EC Number: 628-926-6
Nikkaji: J1.017.150D

물성

구조 계산 물성

극성 표면적: 197 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 18
회전 가능 결합 수: 0
무거운 원자 수: 25
형식 전하: 0
복잡도: 145

물리화학적 성질

녹는점: 300 °C · 300 °C
저장 조건: Inert atmosphere,Room Temperature
용해도: 유기물에 용해됨: 아세토니트릴, 디옥산, 디메틸포름아미드 및 디메틸 설폭사이드.
물리적 상태: 액체
색상: 무색의
안정성: 흡습성
InChI: InChI=1S/3CHF3O3S.Bi/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;;;+3/p-3
InChIKey: HIYUMYXSGIKHHE-UHFFFAOYSA-M
SMILES: C(F)(S([O-])(=O)=O)(F)F.C(F)(F)(F)S([O-])(=O)=O.C(F)(F)(F)S([O-])(=O)=O.[Bi+3]

화학적 성질

White powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H314 (12.8%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (85.1%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (85.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (85.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 5 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 CategoriesSkin Corr. 1B (12.8%)；Skin Irrit. 2 (85.1%)；Eye Irrit. 2 (85.1%)；STOT SE 3 (85.1%)

안전 데이터

wgk: 3
tsca: No
HS 번호: 29049090
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-24/25
위험 등급: 8
위험 참고 사항: Irritant
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

용도Bismuth(III) trifluoromethanesulfonate acts as a catalyst in Friedel-Crafts acylation and cycloisomerization of allene-enol ethers. It behaves as a direct substitution catalyst and involved in the substitution of allylic, propargylic, and benzylic alcohols with sulfonamides, carboxamides and carbamates. Further, it is also used in Mukaiyama aldol reactions.