(트리 플루오로 메틸) 트리메틸 실란

(Trifluoromethyl)trimethylsilane

HCID 552549CAS 81290-20-2

기본 정보

표준 SMILES
C[Si](C)(C)C(F)(F)F
InChIKey
MWKJTNBSKNUMFN-UHFFFAOYSA-N
분자식
C4H9F3Si
평균 분자량
142.19 g/mol
단동위원소 질량
142.04256148

개요

structure in first source

이름 및 식별자

우선 이름
(Trifluoromethyl)trimethylsilane
IUPAC
trimethyl(trifluoromethyl)silane
현지명
(트리 플루오로 메틸) 트리메틸 실란
영어명
(Trifluoromethyl)trimethylsilane
분자식
C4H9F3Si
분자량
142.2

이름 및 동의어

(Trifluoromethyl)trimethylsilane81290-20-2TrifluoromethyltrimethylsilaneRuppert's ReagentTMS-CF3Silane, trimethyl(trifluoromethyl)-Trifluoro(trimethylsilyl)methaneA009786QPJCF3SiMe3(trifluoromethyl)-trimethylsilaneDTXSID20338998RefChem:899606
이름 더 보기
(트라이플루오로메틸)트라이메틸실레인(트리플루오로메틸)트리메틸실란트리메칠실란트리플르오르메칠TTMSRuppert-Prakash reagentTFMTMS(trifluromethyl)trimethylsilanetert-butyl(trifluoromethyl)silaneRuppert'sDKFELEX0262Ruppertreagent
DTXCID00290080Trimethyl(trifluoromethyl)silaneTrifluoromethyltrimethylsilane [MI]MFCD00145454UNII-A009786QPJTMSCF3trimethyl-trifluoromethyl-silaneTrimethylsilyl(trifluoromethane)

데이터베이스 식별자

CAS
81290-20-2
PubChem CID
552549
DTXSID
DTXSID20338998
UNII
A009786QPJ
EC Number
617-210-9
Nikkaji
J357.229C

물성

구조 계산 물성

극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
0
무거운 원자 수
8

실험 및 물리화학적 성질

SpringerMaterials Properties19F nuclear magnetic resonance spectrum

물리화학적 성질

끓는 점
54 · 54-55 °C (lit.)
밀도
0.962 g/mL · 0.962 g/mL at 20 °C (lit.)
증기압
10.98 psi · 10.98 psi ( 55 °C)
굴절률
20 · n20/D 1.386
인화점
14 °F · 14 °F
저장 조건
2 · 2-8°C
화학적 성질 · 1건

(Trifluoromethyl)trimethylsilane (TMSCF3) is a flammable colorless liquid with a boiling point of 54–55 °C, a flash point of –17 °C and density of 0.926 g/mL at 20 °C. It is a trifluoromethylation reagent used in nucleophilic addition reactions of aldehydes and ketones. It may be harmful if inhaled, swallowed, absorbed through skin and may cause respiratory tract, skin and eye irritation. TMSCF3 was firstly synthesized by Rupert in 1984 via the condensation reaction of CF3Br and TMSCl with (Et2N)3P.

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 55 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

안전 데이터

wgk
3
tsca
No
ridadr
UN 1993 3/PG 2
HS 번호
29319090
risk_code
11-36/37-19-36/37/38-22-40-14
hazard_code
F,Xi,Xn

화학 및 산업

응용 분야 · 3건

용도(트리 플루오로 메틸) 트리메틸 실란은 무색 투명한 액체이며 트리 플루오로 메틸화 시약 용으로 사용됩니다.

용도TMSCF3 is versatile reagent for trifluoromethylation, such as transition-metal-catalyzed reaction, miscellaneous trifluoromethylation, and addition to carbonyl and imine groups. These reactions are extremely useful approaches in the pharmaceutical and agrochemical industry, because they enhance metabolic stability (metabolic blocking) and alter the compound properties (liphophilicity, binding selectivity).

일반 설명Trimethyl(trifluoromethyl)silane (TMSCF3) is also called as Ruppert-Prakash fluorination reagent. It is extensively used for the synthesis of trifluoromethyl-containing compounds.

제조 방법

(Trifluoromethyl)trimethylsilane is prepared from trimethylsilyl chloride and bromotrifluoromethane in the presence of a phosphorus(III) reagent that serves as a halogen acceptor.

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]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海恩氟佳科技有限公司15800445152 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

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