기본 정보
- CAS
72486-93-2- 표준 SMILES
C/C=C(O[Si](C)(C)C)/C(C)=C/OC- InChIKey
SSGAQVOLXCOJGN-AZRUORMVSA-N- 분자식
- C10H20O2Si
- 평균 분자량
- 200.35 g/mol
- 단동위원소 질량
- 200.12325641
이름 및 식별자
- 우선 이름
- (1E,3Z)-1-Methoxy-2-methyl-3-(trimethylsilyloxy)-1,3-pentadiene
- IUPAC
- [(1E,3Z)-1-methoxy-2-methylpenta-1,3-dien-3-yl]oxy-trimethylsilane
- 영어명
- (E,Z)-1-Methoxy-2-methyl-3- (trimethylsilyloxy)-1,3-pentadiene
- 분자식
- C10H20O2Si
- 분자량
- 200.35
이름 및 동의어
72486-93-2(1E,3Z)-1-Methoxy-2-methyl-3-(trimethylsilyloxy)-1,3-pentadieneRefChem:392697625-897-1(((1E,3Z)-1-Methoxy-2-methylpenta-1,3-dien-3-yl)oxy)trimethylsilaneSCHEMBL682305SSGAQVOLXCOJGN-AZRUORMVSA-N[(Z)-1-[(E)-2-methoxy-1-methyl-vinyl]prop-1-enoxy]-trimethyl-silane(E,Z)-1 methoxy-2-methyl-3-trimethylsilyloxy-1,3-pentadiene[(Z)-1-[(E)-2-methoxy-1-methyl-vinyl]prop-1-enoxy]-trimethylsilaneTRANS-1-METHOXY-2-METHYL-3-(TRIMETHYLSI&(1E 3Z)-1-METHOXY-2-METHYL-3-(TRIMETHYL&
이름 더 보기
1-Methoxy-2-methyl-3-(trimethylsilyloxy)-1,3-pentadiene[(1-(2-Methoxy-1-methylvinyl)propenyloxy]trimethylsilan(1e,3z)-1-methoxy-2-methyl-3-[(trimethylsilyl)oxy]-penta-1,3-dieneSilane, [[(1Z)-1-[(1E)-2-methoxy-1-methylethenyl]-1-propen-1-yl]oxy]trimethyl-[(1-(2-Methoxy-1-methylvinyl)propenyloxy]trimethylsilan, (1E,3Z)-1-Methoxy-2-methyl-3-[(trimethylsilyl)oxy]-penta-1,3-diene
물성
구조 계산 물성
- 극성 표면적
- 18.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 211
물리화학적 성질
- 끓는 점
- 65 °C/6 · 65 °C/6 mmHg (lit.)
- 밀도
- 0.899 g/mL · 0.899 g/mL at 25 °C (lit.)
- 굴절률
- 20 · n20/D 1.4650(lit.)
- 인화점
- 178 °F · 178 °F
- 저장 조건
- 2 · 2-8°C
- InChI
- 1S/C10H20O2Si/c1-7-10(9(2)8-11-3)12-13(4,5)6/h7-8H,1-6H3/b9-8+,10-7-
- InChIKey
- SSGAQVOLXCOJGN-AZRUORMVSA-N
- SMILES
- CO\C=C(C)\C(O[Si](C)(C)C)=C\C
안전 및 규제
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.；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
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- wgk
- 3
- risk_code
- 22
- hazard_code
- Xn
- Hazard Classifications
- Acute Tox. 4 Oral
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
응용 분야
용도(1E,3Z)-1-Methoxy-2-methyl-3-(trimethylsilyloxy)-1,3-pentadiene used as a reactant for:Preparation of migrastatin analog as cell migration inhibitor for treatment of tumor metastasis2Preparation of dihydropyridinones by chlorosilane-promoted aza-Diels-Alder addition3Synthesis on non-proteinogenic amino esters via stereoselective Lewis acid-catalyzed aza-Diels-Alder cycloaddition with conjugated (cyclo)dienes4
공급사3 곳
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
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