3-(트리메틸실릴)페닐보론산

3-(Trimethylsilyl)phenylboronic acid

HCID 4577181

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 177171-16-3
표준 SMILES: C[Si](C)(C)c1cccc(B(O)O)c1
InChIKey: REMKRZLFPLDTKR-UHFFFAOYSA-N
분자식: C9H15BO2Si
평균 분자량: 194.11 g/mol
단동위원소 질량: 194.09343665

이름 및 식별자

우선 이름: 3-(Trimethylsilyl)phenylboronic acid
IUPAC: (3-trimethylsilylphenyl)boronic acid
현지명: 3-(트리메틸실릴)페닐보론산
영어명: 3-(TRIMETHYLSILYL)PHENYLBORONIC ACID
분자식: C9H15BO2Si
분자량: 194.11

이름 및 동의어

177171-16-33-(Trimethylsilyl)phenylboronic acidDTXSID30404456RefChem:92756DTXCID50355310804-982-9(3-(Trimethylsilyl)phenyl)boronic acid3-Trimethylsilylphenylboronic acid(3-trimethylsilylphenyl)boronic AcidMFCD03093884Boronic acid, [3-(trimethylsilyl)phenyl]-Boronic acid, B-[3-(trimethylsilyl)phenyl]-

이름 더 보기

3-(트리메틸실릴)페닐보론산AKOS BRN-06013-TRIMETHYLSILYLBENZENEBORONIC ACIDm-(Trimethylsilyl)phenylboronic acid3-(trimethylsilyl)phenylboronic acid 98%B-[3-(Trimethylsilyl)phenyl]boronic acid3- (trimethyl silicon) phenylboronic acid3-Trimethylsilylphenylboronic acid - [T5628]3-(Trimethylsilyl)phenylboronic acid >=95.0%

3-Trimethylsilyl phenyl boronic acid[3-(trimethylsilyl)phenyl]boronic acid3-trimethylsilyl-phenylboronic acid(3-(Trimethylsilyl)phenyl)boronicacids200003-(Trimethylsilyl)benzeneboronic AcidFT-0643715SCHEMBL646948

데이터베이스 식별자

CAS: 177171-16-3
PubChem CID: 4577181
DTXSID: DTXSID30404456
EC Number: 804-982-9
Nikkaji: J2.545.533I

물성

구조 계산 물성

극성 표면적: 40.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 167

물리화학적 성질

녹는점: 145 · 145-150 °C (lit.)
끓는 점: 290 ℃ · 290℃
밀도: 1.01 · 1.01
인화점: 129 ℃ · 129℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: 메탄올에 용해됨
물리적 상태: powder to crystal
산도 계수 (pKa): 8.73 · 8.73±0.10(Predicted)
색상: 흰색에서 거의 흰색
InChI: InChI=1S/C9H15BO2Si/c1-13(2,3)9-6-4-5-8(7-9)10(11)12/h4-7,11-12H,1-3H3
InChIKey: REMKRZLFPLDTKR-UHFFFAOYSA-N
SMILES: B(C1=CC=CC([Si](C)(C)C)=C1)(O)O

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (33.3%)

안전 데이터

wgk: 3
HS 번호: 29319090
스토리지 클래스: 13 - Non Combustible Solids

화학 및 산업

응용 분야 · 1건

용도3-(Trimethylsilyl)phenylboronic acid can be used:To prepare a 2-phenylpyridine ligand, which is used in the synthesis of Ir(III) complex applicable in the OLEDs.As an intermediate in the preparation of biphenyl derived amino acids.As a starting material for the synthesis of triphenylene-based electron transport materials.

상·하류 제품 정보

상류 원료

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

杭州奥得科技有限公司0571-88772972-0 15057128248 · [email protected]

安徽勇晟医药科技有限公司181-3307-5798 18017383231 · [email protected]

上海凌凯科技股份有限公司58950110 13124863828 · [email protected]

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