기본 정보
- 표준 SMILES
CCCC[N+](CCCC)(CCCC)CCCC.F[B-](F)(F)F- InChIKey
NNZZSJSQYOFZAM-UHFFFAOYSA-N- 분자식
- C16H36N.BF4
- 평균 분자량
- 329.3 g/mol
- 단동위원소 질량
- 329.28769343
개요
forms a fluoride-releasing resin when used with bis-GMA
이름 및 식별자
- 우선 이름
- Tetrabutylammonium Tetrafluoroborate
- IUPAC
- tetrabutylazanium tetrafluoroborate
- 현지명
- 테트라뷰틸암모늄 플루오로붕산염
- 영어명
- Tetrabutylammonium tetrafluoroborate
- 분자식
- C16H36BF4N
- 분자량
- 329.27
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
429-42-5- PubChem CID
- 67932
- DTXSID
DTXSID7059983- ChEMBL
CHEMBL1078071- EC Number
- 207-058-8
물성
구조 계산 물성
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 135
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- 155 · 155-161 °C(lit.)
- 인화점
- 93 ℃ · >93℃
- 저장 조건
- 20 °C · −20°C
- 용해도
- 0.1 g/mL, · 메탄올: 0.1 g/mL, 투명, 무색
- 물리적 상태
- 결정성 분말
- 색상
- 하얀색
- 수용성
- 약간 용해됨
- BRN
- 3577508 · 3577508
- InChI
- InChI=1S/C16H36N.BF4/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3,4)5/h5-16H2,1-4H3;/q+1;-1
- InChIKey
- DWWRDPSMLREDKW-UHFFFAOYSA-M
- SMILES
- [N+](CCCC)(CCCC)(CCCC)CCCC.[B-](F)(F)(F)F
- NIST
- Tetrabutylammonium tetrafluoroborate(429-42-5)
- EPA
- 1 · 1-Butanaminium, N,N,N-tributyl-, tetrafluoroborate(1-) (429-42-5)
화학적 성질
WHITE FINE CRYSTALLINE POWDER
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 1% (1 of 99) of reports.
Danger
H302 (47.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 99 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 1-Butanaminium, N,N,N-tributyl-, tetrafluoroborate(1-)
Tetrabutylammonium tetrafluoroborate: Does not have an individual approval but may be used under an appropriate group standard
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1759 8/PG III
- HS 번호
- 29239000
- risk_code
- 36/37/38-41-37/38-22
- hazard_code
- Xi,T,Xn
- safety_code
- 26-36-37/39-39
- 포장분류
- III
- 위험 등급
- TOXIC, HYGROSCOPIC
- 기존화학 물질
- KE-34031
- 위험 참고 사항
- Irritant/Hygroscopic
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
용도 및 제조
응용 분야
용도Tetrabutylammonium tetrafluoroborate may be used in the following studies: As supporting electrolyte in the voltammetric determination of Δ(9)-tetrahydrocannabinol (Δ(9)-THC). Synthesis of biologically relevant macrolactones, Sansalvamide A. As supporting electrolyte in the determination of the oxidation and reduction potentials of 5,10,15,20-tetra[3-(3-trifluoromethyl)phenoxy]porphyrin by cyclic voltammetry. Preparation of 1:1 adduct with 1,10-phenanthroline.Used to prepare other tetrabutylammonium salts in aqueous solutions. As electrolyte additive in the synthesis of conducting poly(thiophenes).
일반 설명Tetrabutylammonium tetrafluoroborate (TBATFB) is a phase transfer catalyst. It can be synthesized by the reaction between 30% aqueous solution of tetrafluoroboric acid and 40% aqueous solution of tetrabutylamonium hydroxide. Tetrabutylammonium tetrafluoroborate acts as an electrolyte and inhibits the self-assembly of alkylthiosulfate on gold.
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