기본 정보
- 표준 SMILES
C=CC[Si](C)(C)C- InChIKey
HYWCXWRMUZYRPH-UHFFFAOYSA-N- 분자식
- C6H14Si
- 평균 분자량
- 114.26 g/mol
- 단동위원소 질량
- 114.08647698
개요
used to make allyl C-glycosylic compounds
이름 및 식별자
- 우선 이름
- Allyltrimethylsilane
- IUPAC
- trimethyl(prop-2-enyl)silane
- 현지명
- 알릴트리메틸실란
- 영어명
- Allyltrimethylsilane
- 분자식
- C6H14Si
- 분자량
- 114.26
이름 및 동의어
Allyltrimethylsilane762-72-1Silane, trimethyl-2-propenyl-8B84C337VFSilane, trimethyl-2-propen-1-yl-DTXSID5061089RefChem:110923DTXCID6047862212-104-5Trimethylallylsilane3-(Trimethylsilyl)propeneallyl(trimethyl)silane
이름 더 보기
알릴트라이메틸실레인알릴트리메틸실란allytrimethylsilanetrimethyl-2-propenyl-SilaneDK892CA0570CFS-721TMS-ALLYLCo-Formula CFS-721
trimethyl(prop-2-enyl)silaneCCRIS 2649Silane, allyltrimethyl-trimethyl(prop-2-en-1-yl)silaneEINECS 212-104-5MFCD00008635UNII-8B84C337VF3-(Trimethylsilyl)-1-propene
데이터베이스 식별자
- CAS
762-72-1- PubChem CID
- 69808
- DTXSID
DTXSID5061089- UNII
- 8B84C337VF
- EC Number
- 212-104-5
- Nikkaji
- J129.396F
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
- 7
- 형식 전하
- 0
- 복잡도
- 59.1
실험 및 물리화학적 성질
SpringerMaterials Properties29Si nuclear magnetic resonance spectrum
물리화학적 성질
- 끓는 점
- 84 · 84-88 °C (lit.)
- 밀도
- 0.719 g/mL · 0.719 g/mL at 25 °C (lit.)
- 증기압
- 82 hPa · 82hPa at 25℃
- 굴절률
- 20 · n20/D 1.407(lit.)
- 인화점
- 45 °F · 45 °F
- 저장 조건
- 2 · 2-8°C
- 용해도
- 모든 유기용매를 자유롭게 용해합니다.
- 물리적 상태
- 액체
- Specific Gravity
- 0.72 · 0.72
- 색상
- 무색의
- 수용성
- 불용성
- BRN
- 906755 · 906755
- 안정성
- 휘발성 물질
- InChI
- 1S/C6H14Si/c1-5-6-7(2,3)4/h5H,1,6H2,2-4H3
- InChIKey
- HYWCXWRMUZYRPH-UHFFFAOYSA-N
- SMILES
- C[Si](C)(C)CC=C
- LogP
- 4.64 at · 4.64 at 20℃
- NIST
- -2 · Silane, trimethyl-2-propenyl-(762-72-1)
- EPA
- -2 · Silane, trimethyl-2-propenyl- (762-72-1)
화학적 성질
clear colourless liquid
안전 및 규제
GHS 분류
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 50 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Status: Active Update: 18-11-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/26053
Allyltrimethylsilane: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1993 3/PG 2
- HS 번호
- 29310095
- risk_code
- 11-36/37/38
- hazard_code
- F,Xi
- safety_code
- 16-26-36-23-33-7/9
- 포장분류
- II
- 위험 등급
- 3
- Hazard Classifications
- Flam. Liq. 2Skin Irrit. 2
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
용도 및 제조
General Manufacturing InformationSilane, trimethyl-2-propen-1-yl-: ACTIVE
응용 분야
용도Allyltrimethylsilane is a general reagent to introduce allyl groups across acid chlorides, aldehydes, ketones, iminium ions, enones, and for cross-coupling with other carbon electrophiles. It is used as a reagent in HosomiSakurai reaction.
제조 방법
Allyltrimethylsilane is synthesized by the reaction of trimethylchlorosilane and allylmagnesium bromide.
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