Triethyloxonium tetrafluoroborate

Triethyloxonium tetrafluoroborate 구조식 이미지
카스 번호:
368-39-8
상품명:
Triethyloxonium tetrafluoroborate
동의어(영문):
Meerwein salt;TriethyloxoniuM Fluoroborate;triethyloxonium;SKL1448;SKL1562;TRIETHYLOX;MEERWEIN'S REAGENT;Triethoxonium fluoroborate;Triethyloxytetrafluoroborate;Triethyloxonium terafluoroborate
CBNumber:
CB0198800
분자식:
C6H15BF4O
포뮬러 무게:
189.99
MOL 파일:
368-39-8.mol
MSDS 파일:
SDS

Triethyloxonium tetrafluoroborate 속성

녹는점
96-97°C
밀도
1.328 g/mL at 25 °C
저장 조건
2-8°C
용해도
염화메틸렌: 20mg/mL, 투명, 무색
물리적 상태
가루
색상
하얀색
수용성
물과 반응
감도
Moisture Sensitive
Merck
14,5796
BRN
3598090
노출 한도
ACGIH: TWA 50 ppm
OSHA: TWA 25 ppm; STEL 125 ppm
NIOSH: IDLH 2300 ppm
InChI
InChI=1S/C6H15O.BF4/c1-4-7(5-2)6-3;2-1(3,4)5/h4-6H2,1-3H3;/q+1;-1
InChIKey
IYDQMLLDOVRSJJ-UHFFFAOYSA-N
SMILES
[B-](F)(F)(F)F.[O+](CC)(CC)CC
CAS 데이터베이스
368-39-8(CAS DataBase Reference)
EPA
Oxonium, triethyl-, tetrafluoroborate(1-) (368-39-8)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험품 표기 C
위험 카페고리 넘버 34-40-14-67-37
안전지침서 23-24/25-26-36/37/39-45-22
유엔번호(UN No.) UN 3265 8/PG 2
WGK 독일 2
RTECS 번호 RR4584700
F 고인화성물질 3-10-16-21
위험 참고 사항 Corrosive
TSCA Yes
위험 등급 4.1
포장분류 II
HS 번호 29420000
독성 dnd-smc 500 mmol/L CPBTAL 23,2485,75
그림문자(GHS): GHS hazard pictograms
신호 어: Danger
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H314 피부에 심한 화상과 눈에 손상을 일으킴 피부부식성 또는 자극성물질 구분 1A, B, C 위험 GHS hazard pictograms P260,P264, P280, P301+P330+ P331,P303+P361+P353, P363, P304+P340,P310, P321, P305+ P351+P338, P405,P501
예방조치문구:
P260 분진·흄·가스·미스트·증기·...·스프레이를 흡입하지 마시오.
P280 보호장갑/보호의/보안경/안면보호구를 착용하시오.
P303+P361+P353 피부(또는 머리카락)에 묻으면 오염된 모든 의복은 벗거나 제거하시오 피부를 물로 씻으시오/샤워하시오.
P305+P351+P338 눈에 묻으면 몇 분간 물로 조심해서 씻으시오. 가능하면 콘택트렌즈를 제거하시오. 계속 씻으시오.
P363 다시 사용전 오염된 의류는 세척하시오.
NFPA 704
1
3 2
W

Triethyloxonium tetrafluoroborate MSDS


Triethyloxonium tetrafluoroborate

Triethyloxonium tetrafluoroborate C화학적 특성, 용도, 생산

화학적 성질

white to light yellow crystal powder.

용도

Triethyloxonium tetrafluoroborate is used as a powerful alkylating agent, especially for ethylation. It is used for the modification of carboxyl residues in proteins. It is involved in the preparation of μ-amino esters from lactams. It is also alkylating agent for nucleophilic functional groups in organic synthesis.

주요 응용

Triethyloxonium tetrafluoroborate can be used:
To prepare amino esters by reacting with lactams followed by hydrolysis.
In the preparation of substituted imidazolines from aziridines and nitriles via [3+2]-cycloaddition reaction.
For the N-alkylation of a series of N-arylsulfonyl-α-amino acid methyl esters having variable substituents at 4th position of the sulfonamide aromatic ring.
Synthesis of HDET2.

Safety Profile

Triethyloxonium tetrafluoroborate is a powerful ethylating agent, although the hazards are diminished because it is non-volatile. It releases strong acid upon contact with water. When heated to decomposition it emits toxic vapors of boronand Fí. Mutation data reported.

Synthesis

Triethyloxonium tetrafluoroborate is prepared from boron trifluoride,diethyl ether and epichlorohydrin:
4 Et2O·BF3+ 2 Et2O + 3 C2H3(O)CH2Cl → 3 Et3O+BF4+ B[(OCH(CH2Cl)CH2OEt]3
The trimethyloxonium salt is available from dimethyl ether via an analogous route.These salts do not have long shelf-lives at room temperature. They degrade by hydrolysis:
[(CH3CH2)3O]+BF4+ H2O → (CH3CH2)2O + CH3CH2OH +HBF4

Purification Methods

Crystallise it from diethyl ether. It is very hygroscopic, and must be handled in a dry box and stored at 0o. [Meerwein Org Synth Coll Vol V 1096 1973.] Pure material should give a clear and colourless solution in dichloromethane (1 in 50, w/v). [Beilstein 1 IV 1322.]

Triethyloxonium tetrafluoroborate 준비 용품 및 원자재

원자재

준비 용품


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