기본 정보
- CAS
1760-24-3- 표준 SMILES
CO[Si](CCCNCCN)(OC)OC- InChIKey
PHQOGHDTIVQXHL-UHFFFAOYSA-N- 분자식
- C8H22N2O3Si
- 평균 분자량
- 222.36 g/mol
- 단동위원소 질량
- 222.13996909
개요
RN given refers to parent cpd; a silylating agent
이름 및 식별자
- 우선 이름
- (Trimethoxysilylpropyl)ethylenediamine
- IUPAC
- N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
- 현지명
- N-[3-(트리메톡시실릴)프로필]-1,2-에탄디아민
- 영어명
- N-[3-(Trimethoxysilyl)propyl]ethylenediamine
- 분자식
- C8H22N2O3Si
- 분자량
- 222.36
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
1760-24-3- PubChem CID
- 15659
- DTXSID
DTXSID5027433- ChEMBL
CHEMBL3188366- UNII
- 28ZCS5GA8G
- EC Number
- 217-164-6
- Nikkaji
- J53.972D
물성
구조 계산 물성
- 극성 표면적
- 65.7 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 125
실험 및 물리화학적 성질
Physical Description
Liquid
Light yellow liquid; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- 0 °C · 0°C
- 끓는 점
- 146 °C15 · 146 °C15 mm Hg(lit.)
- 밀도
- 1.028 g/mL · 1.028 g/mL at 25 °C(lit.)
- 증기압
- 1.5 hPa · 1.5 hPa (20 °C)
- 굴절률
- 20 · n20/D 1.444(lit.)
- 인화점
- 220 °F · 220 °F
- 저장 조건
- 30 °C · Store below +30°C.
- 용해도
- 톨루엔과 혼합 가능.
- 물리적 상태
- 액체
- 산도 계수 (pKa)
- 10.11 · 10.11±0.19(Predicted)
- Specific Gravity
- 1.01 · 1.01
- 색상
- 무색투명~연황색
- 수소이온지수(pH)
- 10 · 10 (10g/l, H2O, 20℃)
- 수용성
- 물과 반응
- BRN
- 636230 · 636230
- InChI
- 1S/C8H22N2O3Si/c1-11-14(12-2,13-3)8-4-6-10-7-5-9/h10H,4-9H2,1-3H3
- InChIKey
- PHQOGHDTIVQXHL-UHFFFAOYSA-N
- SMILES
- CO[Si](CCCNCCN)(OC)OC
- LogP
- -4 · -4--0.82 at 20℃
- NIST
- N-(2-Aminoethyl-3-aminopropyl)trimethoxysilane(1760-24-3)
- EPA
- 1 · 1,2-Ethanediamine, N1-[3-(trimethoxysilyl)propyl]- (1760-24-3)
화학적 성질
Colorless transparent liquid
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 28.7% (514 of 1791) of reports.
Danger
H302 (10.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1791 reports by companies from 45 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 1,2-Ethanediamine, N-[3-(trimethoxysilyl)propyl]-
1,2-Ethanediamine, N1-[3-(trimethoxysilyl)propyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2-Ethanediamine, N1-[3-(trimethoxysilyl)propyl]- 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)
Status: Active Update: 05-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/15039
1,2-Ethanediamine, N-(3-(trimethoxysilyl)propyl)-: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
Rapidly hydrolyzed; A moderate skin and severe eye irritant in rabbits; Skin sensitizing potential observed in guinea pig maximization test; No systemic toxicity, reproductive toxicity, or developmental toxicity observed in repeated-dose oral study of rats at doses up to 500 mg/kg/day; [OECD SIDS: N-(3-(Trimethoxysilyl)propyl)ethylenediamine (AEAPTMS) - 2003] May cause eye injury and skin sensitization; [ECHA REACH Registrations] Reacts with water producing methanol; An irritant that may cause serious eye injury; May cause skin sensitization; [Sigma-Aldrich MSDS] See Silane, (4-aminobutyl)diethoxymethyl-. See Methyl alcohol.
안전 및 보호
Protective Action Criteria (PAC)
1.6 [mg/m3]
18 [mg/m3]
110 [mg/m3]
독성 정보
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- KV7400000
- ridadr
- UN 3267 8/PG 2
- 독성
- LD50 orally in Rabbit: 2413 mg/kg LD50 dermal Rat > 2000 mg/kg
- HS 번호
- 29310095
- risk_code
- 38-41-43-52/53-42/43-37/38
- hazard_code
- Xn,Xi
- safety_code
- 26-39-61-37/39-24-36/37/39-23
- 포장분류
- III
- 위험 등급
- 8
- 기존화학 물질
- KE-34385
- F 고인화성물질
- 1-10
- 자연 발화 온도
- 300 °C
- Hazard Classifications
- Acute Tox. 4 InhalationEye Dam. 1Skin Sens. 1BSTOT RE 2 Inhalation
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
용도 및 제조
Uses
A silylating agent. [ChemIDplus] Used as a coupling agent, adhesion promoter, and crosslinker in fiberglass, adhesives, sealants, foundry resins, and coatings; [OECD SIDS: N-(3-(Trimethoxysilyl)propyl)ethylenediamine (AEAPTMS) - 2003]
Molding and Core Making [Category: Foundry]
General Manufacturing Information
All Other Basic Inorganic Chemical Manufacturing
1,2-Ethanediamine, N1-[3-(trimethoxysilyl)propyl]-: ACTIVE
응용 분야
용도N-[3-(Trimethoxysilyl)propyl]ethylenediamine has also been used as an organic ligand for the surface modification of silica gel to uptake heavy metal ions. It can react with fluorinated carbon nanotubes (F-CNT) to form aminoalkylalkoxysilane functionalized carbon nanotubes.
상·하류 제품 정보
상류 원료
공급사100 곳
관련 반응
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