2-(Trimethylsiloxy)-1,3-butadiene

HCID 554657CAS 38053-91-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: C=CC(=C)O[Si](C)(C)C
InChIKey: JOAPBVRQZQYKMS-UHFFFAOYSA-N
분자식: C7H14OSi
평균 분자량: 142.27 g/mol
단동위원소 질량: 142.0813916

개요

See also: 2-(Trimethylsilyloxy)-1,3-butadien (annotation moved to).

이름 및 식별자

우선 이름: 2-(Trimethylsiloxy)-1,3-butadiene
IUPAC: buta-1,3-dien-2-yloxy(trimethyl)silane
영어명: 2-(Trimethylsiloxy)-1,3-butadiene
분자식: C7H14OSi
분자량: 142.27

이름 및 동의어

2-(trimethylsiloxy)-1,3-butadiene2-(trimethylsilyloxy)-1,3-butadieneSilane, trimethyl[(1-methylene-2-propenyl)oxy]-DTXSID40339225Silane, trimethyl((1-methylene-2-propenyl)oxy)-RefChem:462629DTXCID8029030638053-91-7(buta-1,3-dien-2-yloxy)trimethylsilane2-Trimethylsilyloxy-1,3-butadiene2-Trimethylsiloxy-1,3-butadienebuta-1,3-dien-2-yloxy(trimethyl)silane

이름 더 보기

DK767Trimethylsiloxybutadiene(1-Methyleneallyloxy)trime1,3-Butadiene-2-yloxytrimethylsilane(1-Methyleneallyloxy)trimethylsilane2-trimethylsiliconoxy-1,3-butyldiene2-(TRIMETHYLSILOXY)-1,3-BUTADIENE 98+%

MFCD00009852Trimethyl(1-methyleneallyloxy)silaneS187502-Trimethylsilyloxybutadiene2-trimethylsilyloxy-butadieneSCHEMBL27209SCHEMBL54898563-trimethylsiloxy-1,3-butadiene

데이터베이스 식별자

CAS: 38053-91-7
PubChem CID: 554657
DTXSID: DTXSID40339225
Nikkaji: J150.100C

물성

구조 계산 물성

극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 3
무거운 원자 수: 9
형식 전하: 0
복잡도: 121

물리화학적 성질

녹는점: 0 °C · <0°C
끓는 점: 50 °C · 50 °C
밀도: 0.807 · 0.807
굴절률: 1.448 · 1.4480
인화점: 12 °C · 12°C
저장 조건: 2 °C · Store at +2°C to +8°C.
용해도: 에 용해됨 대부분의 표준 유기용매.
물리적 상태: 투명한 액체
Specific Gravity: 0.807 · 0.807
색상: Colorless to Light yellow to Light orange
InChI: 1S/C7H14OSi/c1-6-7(2)8-9(3,4)5/h6H,1-2H2,3-5H3
InChIKey: JOAPBVRQZQYKMS-UHFFFAOYSA-N
SMILES: [Si](OC(=C)C=C)(C)(C)C

안전 및 규제

유해성 정보

Regulatory Information2-(Trimethylsiloxy)-1,3-butadiene: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk: WGK 3 highly water endangering
tsca: No
ridadr: 1992
HS 번호: 2931 90 00
risk_code: 11-23/24/25
safety_code: 16-23-36/37/39-45
포장분류: II
위험 등급: 3
자연 발화 온도: 350 °C
Hazard Classifications: Flam. Liq. 2
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

응용 분야 · 1건

용도2-Trimethylsilyloxy-1,3-butadiene is easily prepared reactive diene for Diels–Alder reactions and other cycloadditions; reactive silyl enol ether for aldol,Michael reactions, and electrophilic additions. It participates in the reactions of Diels–Alder Reactions, Heterodienophiles, [2 + 2] and Other Cycloadditions, Carbene Additions, Aldol Condensations and Electrophilic Additions.