트리스(펜타플루오로페닐)붕화수소

Tris(pentafluorophenyl)borane

HCID 582056

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1109-15-5
표준 SMILES: Fc1c(F)c(F)c(B(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F
InChIKey: OBAJXDYVZBHCGT-UHFFFAOYSA-N
분자식: C18BF15
평균 분자량: 512 g/mol
단동위원소 질량: 511.9853526

이름 및 식별자

우선 이름: Tris(pentafluorophenyl)borane
IUPAC: tris(2,3,4,5,6-pentafluorophenyl)borane
현지명: 트리스(펜타플루오로페닐)붕화수소
영어명: TRIS(PENTAFLUOROPHENYL)BORANE
분자식: C18BF15
분자량: 511.98

이름 및 동의어

Tris(pentafluorophenyl)borane1109-15-5I3WU5E2578DTXSID6074594BF-15RefChem:192143DTXCID4033182601-014-5Tris(perfluorophenyl)boraneTris(2,3,4,5,6-pentafluorophenyl)boraneTRIS(PENTAFLUOROPHENYL)BORONMFCD00269813

이름 더 보기

트리스(펜타플루오로페닐)붕화수소트리스(2,3,4,5,6-펜타플루오로페닐)보란트라이스(펜타플루오로페닐)보레인Tris(Pentafluorophenyl)BorateTris(pentafluorophenyl)boron,min.97%Tris(pentafLperfluorotriphenylboronePERFLUOROTRIPHENYLBORANE

C18BF15TRIS (PENTAFLUORO) PHENYL BORANE135072-62-7Borane, tris(2,3,4,5,6-pentafluorophenyl)-B(C6F5)3PerfluorotriphenylboronBorane, tris(pentafluorophenyl)-tri(pentafluorophenyl)borane

데이터베이스 식별자

CAS: 1109-15-5、135072-62-7
PubChem CID: 582056
DTXSID: DTXSID6074594
UNII: I3WU5E2578
EC Number: 195-368-3、414-000-7、601-014-5
Nikkaji: J640.919I

물성

구조 계산 물성

극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 15
회전 가능 결합 수: 3
무거운 원자 수: 34
형식 전하: 0
복잡도: 566

물리화학적 성질

녹는점: 126 · 126-131 °C (lit.)
끓는 점: 327.3 · 327.3±42.0 °C(Predicted)
밀도: 0.73 g/mL · 0.73 g/mL at 20 °C
굴절률: 20 · n20/D 1.41
인화점: 7 °C · 7 °C
저장 조건: -20 °C · Inert atmosphere,Store in freezer, under -20°C
용해도: 헥산, 클로로포름, 디클로로메탄, 톨루엔 및 극성 용매에 용해됩니다.
물리적 상태: 가루
Specific Gravity: 1.7 · 1.7
색상: 흰색에서 밝은 노란색-베이지색
Merck: 14 · 14,9755
BRN: 2931347 · 2931347
InChI: 1S/C18BF15/c20-4-1(5(21)11(27)16(32)10(4)26)19(2-6(22)12(28)17(33)13(29)7(2)23)3-8(24)14(30)18(34)15(31)9(3)25
InChIKey: OBAJXDYVZBHCGT-UHFFFAOYSA-N
SMILES: Fc1c(F)c(F)c(B(c2c(F)c(F)c(F)c(F)c2F)c3c(F)c(F)c(F)c(F)c3F)c(F)c1F
EPA: Borane, tris(2,3,4,5,6-pentafluorophenyl)- (1109-15-5)

화학적 성질

white powder

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H301 (96.8%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, 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 62 reports by companies from 3 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

Regulatory Information · 2건

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 31-10-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/9908

Hazard Classes and Categories · 2건

Acute Tox. 3 (96.8%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

Skin Irrit. 2 (97.9%)；Eye Irrit. 2 (97.9%)；STOT SE 3 (95.8%)

규제 정보

Regulatory Information · 2건

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 31-10-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/9908

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 1268 3/PG 2
HS 번호: 29039990
risk_code: 36/37/38-25-67-65-50/53-38-11
hazard_code: Xi,T,N,Xn,F
safety_code: 60-61-62-45-37/39-26-36
포장분류: III
위험 등급: 6.1
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids
함량 및 규제정보: 물질구분: 유독물질; 혼합물(제품)함량정보: 트리스(2,3,4,5,6-펜타플루오로페닐)보란 및 이를 25% 이상 함유한 혼합물
유해화학물질 필터링: 2016-1-731(신규화학물질)

화학 및 산업

용도 및 제조

General Manufacturing InformationBorane, tris(2,3,4,5,6-pentafluorophenyl)-: ACTIVE

응용 분야 · 2건

용도Tris(pentafluorophenyl)borane is used as an excellent activator component in homogeneous Ziegler-Natta chemistry. It is also used as a catalyst for reductions, alkylations, hydrometallation reactions and catalyzed aldol-type reactions. It is a useful Lewis acid and catalyzes hydrosilylation of aldehydes. Further, it is used in olefin polymerization catalysis. It serves as a reagent in the preparation of organometallic complexes. In addition to this, it is useful as polymerization catalysts and used to study the heterolytic cleavage of dihydrogen in associated with tri-tert-butylphosphine.

일반 설명B(C6F5)3 is a Lewis acid, stronger than the inorganic parent molecule BF3. In contrast to the prominent Lewis acids, the pentafluorides of the heavier elements of group 15, B(C6F5)3 has no oxidizing properties. B(C6F5)3 forms adducts with neutral and weaker Lewis bases. B(C6F5)3 has the capability to easily accept anionic ligands bonded to metals.