3-아미노프로필디에탄올아민
(3-Aminopropyl)diethanolamine
기본 정보
- CAS
4985-85-7- 표준 SMILES
NCCCN(CCO)CCO- InChIKey
FKJVYOFPTRGCSP-UHFFFAOYSA-N- 분자식
- C7H18N2O2
- 평균 분자량
- 162.23 g/mol
- 단동위원소 질량
- 162.13682782
개요
Aminopropyldiethanolamine appears as a colorless liquid with a faint fishlike odor. May burn though it may require some effort to ignite. Corrosive to tissue. Produces toxic oxides of nitrogen during combustion.
이름 및 식별자
- 우선 이름
- (3-Aminopropyl)diethanolamine
- IUPAC
- 2-[3-aminopropyl(2-hydroxyethyl)amino]ethanol
- 현지명
- 3-아미노프로필디에탄올아민
- 영어명
- N-(3-Aminopropyl)diethanolamine
- 분자식
- C7H18N2O2
- 분자량
- 162.23
이름 및 동의어
(3-Aminopropyl)diethanolamineAminopropyldiethanolamine2,2'-[(3-Aminopropyl)imino]diethanolEthanol, 2,2'-[(3-aminopropyl)imino]bis-N,N-Bis(2-hydroxyethyl)-1,3-diaminopropane2,2'-((3-Aminopropyl)imino)diethanolNSC 8172Ethanol, 2,2'-(aminopropylimino)-R21ZI8N14BAminopropyldiethanolamine (DOT)N-(3-Aminopropyl)iminodiethanolN,N-Bis(hydroxyethyl)-1,3-propanediamine
이름 더 보기
3-아미노프로필디에탄올아민아미노프로필다이에탄올아민N-(3-아미노프로필)디에타놀아민WLN: Z3N2Q2QAMINOPROPYLDIETHANTIMTEC-BB SBB010437RARECHEM AL BW 0829Amifostine Impurity 12DIETHANOLAMINO PROPYLAMINEN-(3-AMINOPROPYL)DIETHANOAMINE
Ethanol, 2,2'-((3-aminopropyl)imino)di-Ethanol, 2,2'-((3-aminopropyl)imino)bis-NSC-8172EINECS 225-642-0AI3-52554EC 225-642-03-[bis(2-hydroxyethyl)amino]propylamineEthanol, 2,2'-[(3-aminopropyl)imino]di-
데이터베이스 식별자
- CAS
4985-85-7- PubChem CID
- 21088
- DTXSID
DTXSID2044680- ChEMBL
CHEMBL3186851- UNII
- R21ZI8N14B
- EC Number
- 225-642-0
- Nikkaji
- J34.795G
물성
구조 계산 물성
- XLogP
- -1.7
- 극성 표면적
- 69.7 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 74.8
실험 및 물리화학적 성질
Physical Description
Aminopropyldiethanolamine appears as a colorless liquid with a faint fishlike odor. May burn though it may require some effort to ignite. Corrosive to tissue. Produces toxic oxides of nitrogen during combustion.
Liquid
Collision Cross Section133.5 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID2044680]
물리화학적 성질
- 끓는 점
- 207 °C · 207 °C
- 밀도
- 1 · 1,07 g/cm3
- 증기압
- 0.001 Pa · 0.001Pa at 25℃
- 굴절률
- 1.4985 · 1.4985 (589.3 nm 27℃)
- 인화점
- 138 °C · 138°C
- 용해도
- 물에 용해됨
- 물리적 상태
- 투명한 액체
- 산도 계수 (pKa)
- 14.4 · 14.40±0.10(Predicted)
- 색상
- 무색~연황색
- 수용성
- 10 g/L · 10g/L at 20℃
- LogP
- -1.74 at · -1.74 at 25℃
- EPA
- (3-Aminopropyl)diethanolamine (4985-85-7)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 83 reports by companies from 3 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Ethanol, 2,2'-[(3-aminopropyl)imino]bis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethanol, 2,2'-[(3-aminopropyl)imino]bis- 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: N-(3-aminopropyl)iminodiethanol (EC: 225-642-0)
DOT LabelCorrosive
Fire HazardsExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Health HazardsExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Reactive GroupAlcohols and Polyols
Reactivity Profile
AMINOPROPYLDIETHANOLAMINE is an aminoalcohol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.
화학 및 산업
용도 및 제조
U.S. Production2023: 1,000,000 - <8,500,000 lb
Consumer UsesMonomers
Industry UsesHardener
General Manufacturing Information
Wholesale and Retail Trade
Ethanol, 2,2'-[(3-aminopropyl)imino]bis-: ACTIVE
응용 분야
일반 설명A colorless liquid with a faint fishlike odor. May burn though N-(3-AMINOPROPYL)DIETHANOLAMINE may require some effort to ignite. Corrosive to tissue. Produces toxic oxides of nitrogen during combustion.
관련 반응
14건
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