3,4,5-Trifluorophenylboronic acid

3,4,5-Trifluorophenylboronic acid 구조식 이미지
카스 번호:
143418-49-9
상품명:
3,4,5-Trifluorophenylboronic acid
동의어(영문):
AKOS BRN-0138;3,4,5-Trifluoropheny;3,4,5-trifluoroborate;5-Trifluorophenylboronic acid;3,4,5-three fluorophenyl borate;3,4,5-Trifluophenylboronic acid;3,4,5-TRIFLUOROPHENYLBORONIC ACID;3,4,5-TRIFLUOROBENZENEBORONIC ACID;3,4,5-Trifluorophenylboronic Aicd;3,4,5-Trifluorobenzeneboronicacid97%
CBNumber:
CB6481302
분자식:
C6H4BF3O2
포뮬러 무게:
175.9
MOL 파일:
143418-49-9.mol

3,4,5-Trifluorophenylboronic acid 속성

녹는점
290-295 °C (lit.)
끓는 점
263.6±50.0 °C(Predicted)
밀도
1,087g/cm
굴절률
1,423-1,425
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
용해도
18.43g/L
산도 계수 (pKa)
6.54±0.11(Predicted)
물리적 상태
가루
색상
갈색을 띤 노란색
BRN
7371914
InChIKey
UHDDEIOYXFXNNJ-UHFFFAOYSA-N
CAS 데이터베이스
143418-49-9(CAS DataBase Reference)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험품 표기 N-Xn,Xi
위험 카페고리 넘버 51/53-36-22-36/37/38
안전지침서 61-26-37/39-36
유엔번호(UN No.) 3077
WGK 독일 3
위험 등급 IRRITANT
HS 번호 29163990
그림문자(GHS): GHS hazard pictogramsGHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H302 삼키면 유해함 급성 독성 물질 - 경구 구분 4 경고 GHS hazard pictograms P264, P270, P301+P312, P330, P501
H319 눈에 심한 자극을 일으킴 심한 눈 손상 또는 자극성 물질 구분 2A 경고 GHS hazard pictograms P264, P280, P305+P351+P338,P337+P313P
H411 장기적 영향에 의해 수생생물에 유독함 수생 환경유해성 물질 - 만성 구분 2
예방조치문구:
P273 환경으로 배출하지 마시오.
P305+P351+P338 눈에 묻으면 몇 분간 물로 조심해서 씻으시오. 가능하면 콘택트렌즈를 제거하시오. 계속 씻으시오.
NFPA 704
0
2 0

3,4,5-Trifluorophenylboronic acid C화학적 특성, 용도, 생산

개요

3,4,5-Trifluorophenylboronic acid is an arylboronic acid compound used in organic synthesis and as a reaction reagent. It can be used as a catalyst to catalyse the direct amidation of amino acid derivatives and the direct polycondensation of carboxylic acids and amines; it can also be used in the formation of new 1:1 co-crystals with urea C6H4BF3O2-CH4N2O components.

화학적 성질

Tan powder

용도

Intermediates of Liquid Crystals

Synthesis

Add 42mmol (10.08g) of magnesium chips into a 1000mL four-necked flask, add 2 pieces of iodine, and then add 200mL of anhydrous 2-methyltetrahydrofuran, heat the temperature to 50°C, and then slowly let it cool down to 40°C. And then drip 4-5mL of 3,4,5-trifluorobromobenzene 84.4g (0.4mol) and 50mL 2-methyltetrahydrofuran mixed solution, trigger the Grignard reaction, the temperature will rise rapidly after the reaction is initiated, use The temperature is lowered to 10-15°C in an ice-water bath, and a mixture (1) composed of 3,4,5-trifluorobromobenzene 84.4g (0.4mol) and 50mL 2-methyltetrahydrofuran (1), trimethyl borate is added dropwise. A mixture of 44 grams (0.42 mol) of ester and 50 mL of 2-methyltetrahydrofuran (2).The speed of the mixed solution (1) and the mixed solution (2) is kept the same, the dropping speed is controlled, and the dropping temperature is kept at 10-15°C . After the dropping is completed, the reaction is continued at room temperature for 8 hours.After the reaction is over, the reaction solution is slowly poured into dilute hydrochloric acid, and after the addition is complete, stir for 0.5-1.5h, separate the liquids, and then extract the aqueous phase twice, combine the organic phases, dry with anhydrous sodium sulfate, spin dry, and Recrystallization of ethyl chloride gave 3,4,5-Trifluorophenylboronic acid with a yield of 78% and a content of 99.6%.

3,4,5-Trifluorophenylboronic acid 준비 용품 및 원자재

원자재

준비 용품


3,4,5-Trifluorophenylboronic acid 공급 업체

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