폴리에틸엔이민

Tetraethylenepentamine

HCID 8197CAS 112-57-2

기본 정보

표준 SMILES
NCCNCCNCCNCCN
InChIKey
FAGUFWYHJQFNRV-UHFFFAOYSA-N
분자식
C8H23N5
평균 분자량
189.3 g/mol
단동위원소 질량
189.19534574

개요

Tetraethylenepentamine appears as a viscous liquid. Slightly less dense than water. Vapors heavier than air. Corrosive to the eyes, skin, mouth, throat and stomach. Vapors irritate the eyes and corrosive to the upper respiratory tract. Vapors may irritate the eyes. Flash point 325 °F.

이름 및 식별자

우선 이름
Tetraethylenepentamine
IUPAC
N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine
현지명
테트라에틸렌펜트아민
영어명
Tetraethylenepentamine
분자식
C8H23N5
분자량
189.3

이름 및 동의어

TETRAETHYLENEPENTAMINE112-57-2Tetren1,4,7,10,13-PentaazatridecaneTetraethylene pentamineTetraethylpentylamine1,11-Diamino-3,6,9-triazaundecane3,6,9-TriazaundecamethylenediamineDEH 263,6,9-Triazaundecane-1,11-diamineAncamine TEPATETRAEN
이름 더 보기
테트라에틸렌펜타민테트라에틸렌펜트아민1,11-다이아미노-3,6,9-트리아자운데칸1,2-에탄아이아민, N-(2-아미노에틸)-N-(2-((2-아미노에틸)아미노)에틸)-1,4,7,10,13-펜타아자트리데칸3,6,9-트리아자운데칸-1,11-다이아미노TetraethyenepentamineN1-(2-aMinoethyl)-N2-(2-((2-aMinoethyl)aMino)ethyl)ethane-1,2-diaMine2-Ethanediaminedeh26TETRENED.E.H. 26Texlin 400
DTXSID7026108YZD1C9KQ28INSULCURE 91,2-Ethanediamine, N-(2-aminoethyl)-N'-[2-[(2-aminoethyl)amino]ethyl]-NSC-886031,2-Ethanediamine, N-(2-aminoethyl)-N'-(2-((2-aminoethyl)amino)ethyl)-DTXCID006108CHEBI:49798

데이터베이스 식별자

CAS
112-57-2、26913-06-4、27233-92-7
PubChem CID
8197
DTXSID
DTXSID7026108
ChEMBL
CHEMBL138297
ChEBI
CHEBI:49798
UNII
YZD1C9KQ28
EC Number
203-986-2、608-018-6、682-669-4
Nikkaji
J5.129B

물성

구조 계산 물성

XLogP
-2.9
극성 표면적
88.1 Ų
수소 결합 공여자 수
5
수소 결합 수용자 수
5
회전 가능 결합 수
10
무거운 원자 수
13

실험 및 물리화학적 성질

Chemical Classes · 2건

Nitrogen Compounds -> Amines, Aliphatic

Corrosives

Drugs · 2건

Pharmaceuticals -> Used in Switzerland

Pharmaceuticals -> Listed in ZINC15

pHALKALINE
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
LogP · 2건

log Kow= 1.503

-3.16 (calculated)

OdorAMMONIACAL; DIAGREEABLE, PENETRATING

물리화학적 성질

녹는점
-40 °C · -40 °C (lit.)
끓는 점
340 °C · 340 °C
밀도
0.998 g/mL · 0.998 g/mL at 25 °C (lit.)
증기 밀도
6.53 · 6.53 (vs air)
증기압
0.01 mm · <0.01 mm Hg ( 20 °C)
굴절률
20 · n20/D 1.505(lit.)

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H302: Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P333+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)

This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1834) of reports.

Danger

H302+H312 (10.6%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]

유해성 정보

Regulatory Information · 4건

Chemical: 1,2-Ethanediamine, N-(2-aminoethyl)-N'-[2-[(2-aminoethyl)amino]ethyl]-

1,2-Ethanediamine, N1-(2-aminoethyl)-N2-[2-[(2-aminoethyl)amino]ethyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2-Ethanediamine, N1-(2-aminoethyl)-N2-[2-[(2-aminoethyl)amino]ethyl]- 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)

Tetraethylenepentamine: Does not have an individual approval but may be used under an appropriate group standard

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.)

Other Safety InformationIMAP assessments - Selected linear polyethyleneamines: Human health tier II assessment
DOT LabelCorrosive
Fire Hazards · 3건

Special Hazards of Combustion Products: Ammonia and toxic oxides of nitrogen may form in fires. (USCG, 1999)

· Combustible material: may burn but does not ignite readily.

Combustible. Gives off irritating or toxic fumes (or gases) in a fire.

Fire PotentialSlight, when exposed to heat or flame.
Health Hazards · 2건

Inhalation may cause nausea and slight irritation; compound is a sensitizer, and prolonged contact may cause asthma. Ingestion can cause burns of mouth, esophagus, and possibly stomach. Contact with eyes or skin may cause burns. Repeated skin contact may cause dermatitis. (USCG, 1999)

· TOXIC and/or CORROSIVE; inhalation, ingestion or skin contact with material may cause severe injury or death.

안전 및 보호

Fire Fighting · 2건

Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Use dry powder, carbon dioxide, water in large amounts, foam.

First Aid Measures · 4건

Fresh air, rest. Half-upright position. Refer immediately for medical attention.

Wear protective gloves when administering first aid. Remove contaminated clothes. Rinse skin with plenty of water or shower for at least 15 minutes. Put clothes in sealable container. Refer immediately for medical attention.

Rinse with plenty of water (remove contact lenses if easily possible). Refer immediately for medical attention.

Rinse mouth. Do NOT induce vomiting. Refer immediately for medical attention.

Accidental Release Measures · 2건

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

General First Aid:

Safe StorageProvision to contain effluent from fire extinguishing. Separated from strong acids, strong oxidants, chlorinated hydrocarbons and food and feedstuffs. Dry. Store in an area without drain or sewer access.
Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).

독성 정보

Environmental Fate · 3건

TERRESTRIAL FATE: An estimated Koc value of 3.6(1,SRC) for tetraethylenepentamine indicates high mobility in soil(2) and leaching may occur(SRC). However, tetraethylenepentamine will exist primarily as a cation under environmental conditions (pH 5-9) and no experimental data are available which suggest whether it will adsorb to soil more strongly than its estimated Koc value indicates. Volatilization from moist soils is not expected to be rapid based upon a low Henry's Law constant. Amines are potentially susceptible to hydrolysis(1). Therefore, tetraethylenepentamine is expected to hydrolyze in moist soils; however, no rates were located(SRC). Furthermore, no data were located which suggest biodegradation is an important terrestrial fate process of tetraethylenepentamine(SRC).

AQUATIC FATE: Based on an estimated Henry's Law constant of 3.0X10-20 atm-cu m/mole at 25 °C(2), tetraethylenepentamine is expected to be essentially nonvolatile from water(1). An estimated Koc of 3.6 and BCF of 4.2 suggest that adsorption to sediment and bioconcentration in aquatic organisms may not be important fate processes for tetraethylenepentamine in water systems(1). Based on pKa1, pKa2, pKa3, pKa4, and pKa5 values of 9.68, 9.10, 8.08, 4.72, and 2.98(3), respectively, tetraethylenepentamine will exist primarily as a cation under environmental conditions (pH 5-9). However, no experimental data are available which suggest whether it will adsorb to sediment more strongly than its estimated Koc value indicates. Amines are potentially susceptible to hydrolysis(4). Therefore, tetraethylenepentamine may hydrolyze in aquatic environments, but no rates were located(SRC). Furthermore, no data were located which suggest biodegradation is an important environmental fate process of tetraethylenepentamine in aquatic systems(SRC).

ATMOSPHERIC FATE: Based on a measured vapor pressure of 8.0X10-7 mm Hg at 25 °C(1), tetraethylenepentamine may exist in both the particulate and vapor phases in the ambient atmosphere(3). Vapor phase tetraethylenepentamine is degraded in the ambient atmosphere by reaction with photochemically formed hydroxyl radicals; the half-life for this reaction in air can be estimated to be about 1.2 hrs(2,SRC). Particulate phase tetraethylenepentamine may be susceptible to dry deposition. Also, based on its complete water solubility at 20 °C(4), removal from air via wet deposition is likely to occur(SRC).

Adverse EffectsDermatotoxin - Skin burns.
Exposure RoutesSerious local effects by all routes of exposure.
Signs and Symptoms · 4건

Cough. Sore throat. Burning sensation. Shortness of breath. Laboured breathing.

Redness. Pain. Skin burns.

Redness. Pain. Burns.

Burns in mouth and throat. Burning sensation in the throat and chest. Shock or collapse.

ICSC Environmental DataThe substance is toxic to aquatic organisms. The substance may cause long-term effects in the aquatic environment. It is strongly advised not to let the chemical enter into the environment.
Soil Adsorption/Mobility · 1건

Based on an estimated log Kow of -1.503(2) and a recommended regression derived equation(1), the Koc for tetraethylenepentamine can be estimated to be about 3.6(SRC). This Koc value suggests that tetraethylenepentamine will be highly mobile in soil and sediment(4). Based on pKa1, pKa2, pKa3, pKa4, and pKa5 values of 9.68, 9.10, 8.08, 4.72, and 2.98(3), respectively, tetraethylenepentamine will exist primarily as a cation under environmental conditions (pH 5-9); no experimental data are available which suggest whether the cation will adsorb more strongly than its estimated Koc value indicates(SRC).

규제 정보

FDA RequirementsTetraethylenepentamine is an indirect food additive for use only as a component of adhesives.

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
KH8585000
ridadr
UN 2320
독성
LD50 orally in Rabbit: 3990 mg/kg LD50 dermal Rabbit 660 mg/kg
HS 번호
29212900

화학 및 산업

약리 정보

Cellular LocationsCytoplasm

용도 및 제조

Uses · 5건

Used to make oil and fuel additives, paints, and asphalt adhesives; [INCHEM] Used as an epoxy resin hardener; [Reference #1] Used as a solvent for acid gases, resins, and dyes; Also used as a chemical intermediate and in paper manufacturing; [AIHA]

Pulp and Paper Processing [Category: Industry]

SOLVENT FOR SULFUR, ACID GASES, VARIOUS RESINS & DYES; SAPONIFYING AGENT FOR ACIDIC MATERIALS

CHEM INT FOR LUBRICATING OIL ADDITIVES & SURFACTANTS, CASTOR OIL ADDUCTS USED AS EMULSIFIERS, IMIDAZOLINE COMPOUNDS, VWT-STRENGTH RESINS, & REACTIVE POLYAMIDE HARDENERS IN EPOXY RESINS; COAGULATION AID FOR SYNTHETIC RUBBER LATEXES.

In papermaking

U.S. Exports · 2건

(1978) 1.96X10+9 GRAMS

(1979) 1.88X10+9 GRAMS

U.S. Production · 3건

2023: 4,000,000 - <5,500,000 lb

(1977) PROBABLY GREATER THAN 4.54X10+6 GRAMS

(1979) PROBABLY GREATER THAN 4.54X10+6 GRAMS

Industry UsesEmulsifier
Methods of ManufacturingREACTION OF AQUEOUS AMMONIA WITH 1,2-DICHLOROETHANE FOLLOWED BY NEUTRALIZATION (EG, WITH AQUEOUS CAUSTIC SODA) AND FRACTIONAL DISTILLATION
Household ProductsInformation on 10 consumer products that contain Tetraethylenepentamine in the following categories is provided:
응용 분야 · 2건

용도Solvent for sulfur, acid gases, and various resins and dyes; saponifying agent for acidic materials; manufacture of synthetic rubber; dispersant in motor oils; intermediate for oil additives.

일반 설명A viscous liquid. Slightly less dense than water. Vapors heavier than air. Corrosive to the eyes, skin, mouth, throat and stomach. Vapors irritate the eyes and corrosive to the upper respiratory tract. Vapors may irritate the eyes. Flash point 325°F.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
山东旭晨化工科技有限公司0533-15715337262 15715337262 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]

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