트리알릴아민

트리-2-프로페닐아민 · 트리알릴아민 · TAA · Trialkylamine · N,N-Diallyl-2-propen-1-amine · 2-Propen-1-amine, N,N-di-2-propen-1-yl- · (CH2=CHCH2)3N · tertiaryamine

https://huagongshe.com/ko/chemical/7617

식별자 및 물리적 특성

CAS No.	102-70-5
분자식	C9H15N
평균 분자량	137.22 g/mol
단동위원소 질량	137.12044948 g/mol
SMILES	C=CCN(CC=C)CC=C
InChIKey	VPYJNCGUESNPMV-UHFFFAOYSA-N
PubChem CID	7617
ChEMBL	CHEMBL3188834
ChEBI	CHEBI:192451
EC No.	203-048-2
DTXSID	DTXSID5026174
현지명	트리알릴아민

화학 및 물리적 성질

XLogP	2.6
극성 표면적	3.2
수소 결합 공여자 수	0
수소 결합 수용자 수	1
회전 가능 결합 수	6
무거운 원자 수	10
형식 전하	0
복잡도	92.1
물질 분류	Nitrogen Compounds -> Amines, AliphaticFlammable agents - 2nd degree
SpringerMaterials Properties	Optical coefficient
LogP(분배 계수)	log Kow= 2.59
냄새	Ammonia-like
밀도	0.809 at 68 °F (NTP, 1992) - Less dense than waterwill float0.809 @ 20 °C0.79 g/mL at 25 °C (lit.)
Viscosity	2.7783X10-3 Pa.s @ 200.00 K
Color/Form	LiquidDark brown liquid
용해도	2.5 mg/mL (NTP, 1992)Soluble in ethanol, ethyl ether, acetone, and benzeneIn water, 2,500 mg/l @ 25 °C
인화점	103 °F (NTP, 1992)103 °F OC.87 °F
끓는 점	311 to 313 °F at 760 mmHg (NTP, 1992)155.5 °C150-151 °C (lit.)
Decomposition	When heated to decomposition it emits toxic fumes of /nitrogen oxides/.
녹는점	-94 °F (NTP, 1992)less than -70 °C-70°C
증기 밀도	4.73 (vs air)
증기압	90 mm Hg ( 80 °C)
굴절률	n20/D 1.451(lit.)
저장 조건	2-8°C
pKa(산도 계수)	pK1:8.31(+1) (25°C)
물리적 상태	투명한 액체
색상	무색~황색~주황색
용해도	250g/100mL
헨리 상수	3.9×10-2 mol/(m3Pa) at 25℃, Brockbank (2013)
안정성	안정적인. 가연성. 강한 산화제와 호환되지 않습니다.
InChI	1S/C9H15N/c1-4-7-10(8-5-2)9-6-3/h4-6H,1-3,7-9H2
InChIKey	VPYJNCGUESNPMV-UHFFFAOYSA-N
SMILES	C=CCN(CC=C)CC=C
NIST	2-Propen-1-amine, N,N-di-2-propenyl-(102-70-5)
EPA	Triallylamine (102-70-5)

화학적 성질

Triallylamine is a flammble liquid. Triallylamine can be detected at 0.5 ppm and is severely irritating at 75 ppm.

안전 및 규제

GHS 분류	DangerH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P361+P364, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 165 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H226: Flammable liquid and vapor [Warning Flammable liquids]
규제 정보	Chemical: 2-Propen-1-amine, N,N-di-2-propenyl-2-Propen-1-amine, N,N-di-2-propen-1-yl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propen-1-amine, N,N-di-2-propen-1-yl- 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: 14-02-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/223092-Propen-1-amine, N,N-di-2-propenyl-: 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.The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
운송 라벨(DOT)	Flammable Liquid Corrosive
화재 위험	Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:· Flammable/combustible material.
화재 가능성	MODERATE FIRE RISK...DANGEROUS, WHEN EXPOSED TO HEAT OR FLAME.Flammable liquid when exposed to heat, flame, or oxidizers.
건강 유해성	Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:· May cause toxic effects if inhaled or ingested.
유해성 요약	Subjects recognize an offensive odor at about 0.5 ppm and have more severe symptoms of coughing and nausea at 75-100 ppm. In animal studies, it can cause pneumonitis and liver/kidney injury after heavy inhalation exposures. Death occurs after repeated exposures to 100-200 ppm. [HSDB] Corrosive to the skin, respiratory tract, and eyes

용도

Triallylamine is used in organic synthesis.Triallylamine has been proposed as a catalyst for the production of polyesters and as an initiator for the polymerization of butadiene.

일반 설명

A colorless liquid with a fishlike odor. Density 0.800 g / cm3 and insoluble in water. Hence floats on water. Flash point 103°F. Vapors heavier than air. May irritate skin and eyes. Used to make other chemicals.

제조 및 합성 방법

생산 방법

Triallylamine is manufactured using allyl chloride and ammonia under heat and pressure. It is used as a solvent and in organic syntheses.