기본 정보
- CAS
3989-13-7- 표준 SMILES
C[Si](C)(C)C#Cc1cccc(Br)c1- InChIKey
BXXMHQYHYOTTPM-UHFFFAOYSA-N- 분자식
- C11H13BrSi
- 평균 분자량
- 253.21 g/mol
- 단동위원소 질량
- 251.99698905
이름 및 식별자
- 우선 이름
- ((3-Bromophenyl)ethynyl)trimethylsilane
- IUPAC
- 2-(3-bromophenyl)ethynyl-trimethylsilane
- 영어명
- (3-Bromophenylethynyl)trimethylsilane
- 분자식
- C11H13BrSi
- 분자량
- 253.21
이름 및 동의어
((3-bromophenyl)ethynyl)trimethylsilane[(3-Bromophenyl)ethynyl]trimethylsilaneRefChem:389984878-379-43989-13-7(3-Bromophenylethynyl)trimethylsilane2-(3-bromophenyl)ethynyl-trimethylsilaneMFCD01863664[2-(3-BROMOPHENYL)ETHYNYL]TRIMETHYLSILANE2-(3-bromophenyl)ethynyl-trimethyl-silane1-Bromo-3-[2-(trimethylsilyl)ethynyl]benzene[(3-bromophenyl)ethynyl](trimethyl)silane
이름 더 보기
(3-bromobenzenethynyl)trimethylsiliconalkaneBenzene, 1-bromo-3-[2-(trimethylsilyl)ethynyl]-((3-Bromophenyl)ethynyl)trimethylsilane - [B88338]
SCHEMBL2795902DTXSID80394999BXXMHQYHYOTTPM-UHFFFAOYSA-N3-bromophenyltrimethylsilylacetylene1-bromo-3trimethylsilylethynylbenzene3-(trimethylsilylethynyl)bromobenzene1-bromo-3-trimethylsilylethynylbenzeneAKOS015913287
데이터베이스 식별자
- CAS
3989-13-7- PubChem CID
- 3683324
- DTXSID
DTXSID80394999- EC Number
- 878-379-4
- Nikkaji
- J1.821.634E
물성
구조 계산 물성
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 227
물리화학적 성질
- 끓는 점
- 80 °C/0.2 · 80 °C/0.2 mmHg (lit.)
- 밀도
- 1.189 g/mL · 1.189 g/mL at 25 °C (lit.)
- 굴절률
- 20 · n20/D 1.555(lit.)
- 인화점
- 230 °F · >230 °F
- 저장 조건
- 2 · 2-8°C
- InChI
- 1S/C11H13BrSi/c1-13(2,3)8-7-10-5-4-6-11(12)9-10/h4-6,9H,1-3H3
- InChIKey
- BXXMHQYHYOTTPM-UHFFFAOYSA-N
- SMILES
- C[Si](C)(C)C#Cc1cccc(Br)c1
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
응용 분야
용도(3-Bromophenylethynyl)trimethylsilane may be used in the preparation of 4-(3-bromophenyl)-3-butyn-2-one.
일반 설명(3-Bromophenylethynyl)trimethylsilane is an internal alkyne.
상·하류 제품 정보
하류 제품
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