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2-시아노에틸트리에톡시실란

(2-Cyanoethyl)triethoxysilane

HCID 13522
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
919-31-3
표준 SMILES
CCO[Si](CCC#N)(OCC)OCC
InChIKey
GBQYMXVQHATSCC-UHFFFAOYSA-N
분자식
C9H19NO3Si
평균 분자량
217.34 g/mol
단동위원소 질량
217.11342

개요

structure in first source

이름 및 식별자

우선 이름
(2-Cyanoethyl)triethoxysilane
IUPAC
3-triethoxysilylpropanenitrile
현지명
2-시아노에틸트리에톡시실란
영어명
2-Cyanoethyltriethoxysilane
분자식
C9H19NO3Si
분자량
217.34

이름 및 동의어

919-31-33-(TRIETHOXYSILYL)PROPIONITRILE(2-Cyanoethyl)triethoxysilanePropanenitrile, 3-(triethoxysilyl)-beta-Cyanoethyltriethoxysilane3-(Triethoxysilyl)propiononitrilePropionitrile, 3-(triethoxysilyl)-Silane, (2-cyanoethyl)triethoxy-DTXSID70273340I8R6D195FNSC-77092DTXCID807334
이름 더 보기
2-시아노에틸트리에톡시실란ZERENEX ZX007473cyanoethyltriethoxysilaneB-CYANOETHYLTRIETHOXYSILANE2-Cycnoethyltriethoxysilane(2-cyanoethyl)triethoxy-silanTriethoxy 2-cyanoethyl silane
RefChem:496285213-050-52-Cyanoethyltriethoxysilane3-(Triethoxysilyl)propanenitrile3-triethoxysilylpropanenitrileTriethoxy-2-kyanethylsilanHSDB 5768Triethoxy-2-kyanethylsilan [Czech]

데이터베이스 식별자

CAS
919-31-3
PubChem CID
13522
DTXSID
DTXSID7027334
ChEMBL
CHEMBL3181996

물성

구조 계산 물성

극성 표면적
51.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
8
무거운 원자 수
14
형식 전하
0
복잡도
173

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Nitriles
Physical Description · 2건

Liquid

Colorless liquid; [MSDSonline]

물리화학적 성질

끓는 점
224 °C · 224 °C (lit.)
밀도
0.979 g/mL · 0.979 g/mL at 25 °C (lit.)
증기압
1.9 Pa · 1.9Pa at 20℃
굴절률
20 · n20/D 1.414(lit.)
인화점
212 °F · 212 °F
물리적 상태
액체
Specific Gravity
0.979 · 0.979
색상
무색 내지 거의 무색
수용성
물에서 가수분해됩니다.
BRN
1776392 · 1776392
InChI
1S/C9H19NO3Si/c1-4-11-14(12-5-2,13-6-3)9-7-8-10/h4-7,9H2,1-3H3
InChIKey
GBQYMXVQHATSCC-UHFFFAOYSA-N
SMILES
CCO[Si](CCC#N)(OCC)OCC
EPA
3 · Propanenitrile, 3-(triethoxysilyl)- (919-31-3)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 7.1% (5 of 70) of reports.

Warning

H315 (91.4%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 70 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: Propanenitrile, 3-(triethoxysilyl)-

Propanenitrile, 3-(triethoxysilyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanenitrile, 3-(triethoxysilyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: 3-(triethoxysilyl)propiononitrile (EC: 213-050-5)

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazards Summary · 1건

Emergency treatment: Propionitrile; In one reported case of propionitrile poisoning, there was rapid loss of consciousness; [HSDB] Mild irritant on skin of rabbit; [RTECS] Violent convulsions prior to death in lethal dose studies of rats; Not expected to be genotoxic; Animal data does not show reproductive or developmental toxicity; [OECD SIDS] An irritant; May be harmful if swallowed; [Aldrich MSDS] See NITRILES.

Special ReportsKaplita PV and Smith RP; Toxicol Appl Pharmacol 84 (3): 533-540 (1986). Pathways for the bioactivation of aliphatic nitriles to free cyanide in mice.

화학 및 산업

용도 및 제조

U.S. Production2023: 1,000,000 - <5,000,000 lb
Industry UsesIntermediate
General Manufacturing Information · 2건

All Other Basic Organic Chemical Manufacturing

Propanenitrile, 3-(triethoxysilyl)-: ACTIVE

응용 분야 · 2건

용도(2-Cyanoethyl)triethoxysilane is an ethoxylated silicate that has been used as a coating for aluminum and quartz.

일반 설명3-(Triethoxysilyl)propionitrile (TESPN) is an organosilyl sol gel that can be used as a silane based coupling agent to improve the adhesion between metal-polymeric composite. It is non-toxic and cost efficient which makes it a suitable alternative to the existing chromate treatment of metals. It can be used in surface modification of silica based surfaces.

공급사72 곳

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관련 반응

4건
반응 기록 만들기
HRID 312559 반응식
HRID 312559반응물로Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1855938 반응식
HRID 1855938반응물로uspto-grants-1980_08
HRID 1855939 반응식
HRID 1855939반응물로uspto-grants-1980_08
HRID 2124395 반응식
HRID 2124395반응물로Training data from https://doi.org/10.1039/C8SC04228D (4/10)

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
UNII
0I8R6D195F
EC Number
213-050-5
Nikkaji
J21.099D
Hazard Classes and Categories
Skin Irrit. 2 (91.4%)

독성 정보

Adverse EffectsOther Poison - Chemical Asphyxiant

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
VV2750000
HS 번호
29319090
risk_code
36/37/38
hazard_code
Xi
safety_code
26
F 고인화성물질
10-21
스토리지 클래스
10 - Combustible liquids
유해 물질 데이터
919-31-3(Hazardous Substances Data)
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