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2-(3,4-에폭시시클로헥실)에틸트리메톡시실란

Epoxycyclohexylethyltrimethoxysilane

HCID 18819
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기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
3388-04-3
표준 SMILES
CO[Si](CCC1CCC2OC2C1)(OC)OC
InChIKey
DQZNLOXENNXVAD-UHFFFAOYSA-N
분자식
C11H22O4Si
평균 분자량
246.37 g/mol
단동위원소 질량
246.12873571

이름 및 식별자

우선 이름
Epoxycyclohexylethyltrimethoxysilane
IUPAC
trimethoxy-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silane
현지명
2-(3,4-에폭시시클로헥실)에틸트리메톡시실란
영어명
Trimethoxy[2-(7-oxabicyclo[4.1.0]hept-3-yl)ethyl]silane
분자식
C11H22O4Si
분자량
246.38

이름 및 동의어

3388-04-3Silane A 186A 186 (heterocycle)Silquest A 186NUCA 186KBM 303A 186 (coupling agent)(3,4-Epoxycyclohexyl)ethyltrimethoxysilaneEpoxycyclohexylethyl trimethoxy silane[2-(3,4-Epoxycyclohexyl)ethyl]trimethoxysilaneE 6250Y 4086
이름 더 보기
2-(3,4-에폭시사이클로헥실)에틸트리메톡시실란2-(3,4-에폭시시클로헥실)에틸트리메톡시실란2-(3,4-에폭시사이클로헥실)에틸트리메톡시실란(2-(3,4-EPOXYCYCLOHEXYL)ETHYLTRIMET...2-(3,4-EPOXYCYCLOHEXYL)ETHYLTRIMETHOXYSILANEs530kbm303A 186e6250y4086CE6250
SXJ79LS078((Epoxycyclohexyl)ethyl)trimethoxy silaneS 530(2-(3,4-Epoxycyclohexyl)ethyl)trimethoxysilane3-(2-(Trimethoxysilyl)ethyl)-7-oxabicyclo(4.1.0)heptane4-(2-(Trimethoxysilyl)ethyl)-7-oxabicyclo(4.1.0)heptaneepoxycyclohexylethyltrimethoxysilane3-[2-(Trimethoxysilyl)ethyl]-7-oxabicyclo[4.1.0]heptane

데이터베이스 식별자

CAS
3388-04-3
PubChem CID
18819
DTXSID
DTXSID1043910
UNII
SXJ79LS078
EC Number
222-217-1
Nikkaji
J54.321G

물성

구조 계산 물성

극성 표면적
40.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
6
무거운 원자 수
16
형식 전하
0
복잡도
224

실험 및 물리화학적 성질

PolymersPlastics & Rubber -> Epoxides
Physical DescriptionColorless liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점
0 °C · <0°C
끓는 점
310 °C · 310 °C(lit.)
밀도
1.065 g/mL · 1.065 g/mL at 25 °C(lit.)
증기압
0.46 Pa · 0.46Pa at 25℃
굴절률
20 · n20/D 1.451(lit.)
인화점
230 °F · >230 °F
저장 조건
2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태
액체
Specific Gravity
1.065 · 1.065
색상
무색 내지 거의 무색
수용성
1.4 g/L · 1.4g/L at 20℃
BRN
8980119 · 8980119
InChI
1S/C11H22O4Si/c1-12-16(13-2,14-3)7-6-9-4-5-10-11(8-9)15-10/h9-11H,4-8H2,1-3H3
InChIKey
DQZNLOXENNXVAD-UHFFFAOYSA-N
SMILES
CO[Si](CCC1CCC2OC2C1)(OC)OC
LogP
2.5 at · 2.5 at 20℃
NIST
1 · 1-[2-(Trimethoxysilyl)ethyl]cyclohexane-3,4-epoxide(3388-04-3)
EPA
3 · 3,4-Epoxycyclohexylethyltrimethoxysilane (3388-04-3)

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 9.8% (32 of 325) of reports.

Danger

H317 (61.2%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P203, P261, P272, P273, P280, P302+P352, P318, P321, P333+P317, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 325 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: Silane, trimethoxy[2-(7-oxabicyclo[4.1.0]hept-3-yl)ethyl]-

REACH registered substance: 2-(3,4-epoxycyclohexyl)ethyltrimethoxysilane (EC: 222-217-1)

Silane, trimethoxy2-(7-oxabicyclo4.1.0hept-3-yl)ethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

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

No evidence of embryotoxicity or teratogenicity in oral studies of rats and rabbits; [Shepard's Catalog of Teratogenic Agents] A mild skin irritant; Oral LD50 (rat) = 8 mL/kg; [RTECS] May cause irritation; May cause eye, liver, kidney, and heart injury; Possible carcinogen; [Sigma-Aldrich MSDS]

Hazard Classes and CategoriesSkin Sens. 1 (61.2%)

독성 정보

Toxicity DataLC (mouse) > 290 mg/m3/4hr

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
VV4000000
독성
LD50 oral in rat: 8mL/kg
HS 번호
29319090
risk_code
45-46-45/46
hazard_code
T
safety_code
53-23-36/37/39-45
기존화학 물질
KE-34367
F 고인화성물질
3-10
Hazard Classifications
Aquatic Chronic 3Carc. 2Muta. 2Skin Sens. 1B
스토리지 클래스
10 - Combustible liquids

화학 및 산업

용도 및 제조

General Manufacturing Information7-Oxabicyclo[4.1.0]heptane, 3-[2-(trimethoxysilyl)ethyl]-: ACTIVE
응용 분야 · 1건

용도Trimethoxy[2-(7-oxabicyclo[4.1.0]hept-3-yl)ethyl]silane may be used as a precursor to form SiCOH film via sol-gel. The silane may be used to functionalize alumina nanoparticles towards the fabrication of polyamide 12/alumina nanocomposites. 4 Basalt fibers were functionalized with this silane and its consequent effect on the fabrication of basalt fiber–epoxidized vegetable oil matrix composite materials was analyzed.Trimethoxy[2-(7-oxabicyclo[4.1.0]hept-3-yl)ethyl]silane can be used as a silane based coupling agent to functionalize a variety of substrates. It modifies the surface to improve the dispersion of nanoparticles. It can be used as an adhesion promoter by treating the precursor material with epoxy silanes.

관련 반응

10건
반응 기록 만들기
HRID 46411 반응식
HRID 46411생성물로uspto-grants-1979_11
HRID 252877 반응식
HRID 252877반응물로uspto-grants-2011_01
HRID 252878 반응식
HRID 252878반응물로uspto-grants-2011_01
HRID 252879 반응식
HRID 252879반응물로uspto-grants-2011_01
HRID 1112433 반응식
HRID 1112433반응물로uspto-grants-1978_10
HRID 1219927 반응식
HRID 1219927생성물로Training data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1655162 반응식
HRID 1655162생성물로uspto-grants-1993_10
HRID 1737124 반응식
HRID 1737124생성물로uspto-grants-1999_10
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