디이소프로필아미노에탄올

2-Diisopropylaminoethanol

HCID 7313CAS 96-80-0

기본 정보

표준 SMILES: CC(C)N(CCO)C(C)C
InChIKey: ZYWUVGFIXPNBDL-UHFFFAOYSA-N
분자식: C8H19NO
평균 분자량: 145.24 g/mol
단동위원소 질량: 145.14666423

개요

N,n-diisopropyl ethanolamine appears as a colorless liquid. Slightly soluble in water and less dense than water. Severely irritates skin and eyes. Used to make other chemicals.

이름 및 식별자

우선 이름: 2-Diisopropylaminoethanol
IUPAC: 2-[di(propan-2-yl)amino]ethanol
현지명: 디이소프로필아미노에탄올
영어명: 2-Diisopropylaminoethanol
분자식: C8H19NO
분자량: 145.24

이름 및 동의어

2-DiisopropylaminoethanolRefChem:8193002-(Diisopropylamino)ethanol96-80-0(Diisopropylamino)ethanolDiisopropylethanolamineN,N-DiisopropylethanolamineN,N-DiisopropylaminoethanolN,N-Diisopropyl ethanolamineEthanol, 2-[bis(1-methylethyl)amino]-(N,N-Diisopropylamino)ethanolEthanol, 2-(diisopropylamino)-

이름 더 보기

2-(다이아이소프로필아미노)에탄올디이소프로필아미노에탄올2-디이소프로필아미노에탄올DIISOPROPYLAMINOETHANOLn,n-diisopropylDiisopropylethanolaminDI-ISO-PROPYLAMINETHANOLAcotinamide impurity c-5N,N-DIISOPROYLETHANOAMINEEthanol, diisopropylamino-N,N-diisopropylethanoaMine

2-(Diisopropylamino)ethyl alcohol2-[di(propan-2-yl)amino]ethanolNSC 454752-[Bis(Propan-2-Yl)Amino]Ethan-1-OlDTXSID6021822DK7FND4TJZMonoethanoldiisopropylamine2-Diisopropylamino-ethanol

데이터베이스 식별자

CAS: 96-80-0
PubChem CID: 7313
DTXSID: DTXSID6021822
ChEMBL: CHEMBL122184
UNII: DK7FND4TJZ
EC Number: 202-536-2
Nikkaji: J34.788D

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 23.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 4
무거운 원자 수: 10
형식 전하: 0
복잡도: 73.3

실험 및 물리화학적 성질

Chemical ClassesCorrosives

SpringerMaterials PropertiesOptical coefficient

Density0.826 @25 °C

Flash Point175 °F (NFPA, 2010)

Boiling Point190 °C @760 [mm Hg]

Physical DescriptionN,n-diisopropyl ethanolamine appears as a colorless liquid. Slightly soluble in water and less dense than water. Severely irritates skin and eyes. Used to make other chemicals.

물리화학적 성질

녹는점: -39 °C · -39 °C
끓는 점: 187 · 187-192 °C(lit.)
밀도: 0.826 g/mL · 0.826 g/mL at 25 °C(lit.)
증기 밀도: 5 · 5 (vs air)
증기압: 1 mm · <1 mm Hg ( 20 °C)
굴절률: 20 · n20/D 1.442(lit.)
인화점: 158 °F · 158 °F
저장 조건: Refrigerator, under inert atmosphere
용해도: 클로로포름, 메탄올(약간)에 용해됨
물리적 상태: 기름
산도 계수 (pKa): 14.75 · 14.75±0.10(Predicted)
색상: 밝은 노란색에서 노란색까지
BRN: 1697955 · 1697955
Henry's Law Constant: 2.2 · 2.2×100 mol/(m3Pa) at 25℃, Du et al. (2017)
안정성: 안정적인. 산, 강한 산화제와 호환되지 않습니다.
InChIKey: ZYWUVGFIXPNBDL-UHFFFAOYSA-N
NIST: (Diisopropylamino)ethanol(96-80-0)
EPA: 2 · Ethanol, 2-[bis(1-methylethyl)amino]- (96-80-0)

화학적 성질

colourless to slightly yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 182 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: Ethanol, 2-[bis(1-methylethyl)amino]-

Status: Active Update: 25-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21097

Ethanol, 2-bis(1-methylethyl)amino-: 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.)

DOT LabelCorrosive

Fire HazardsExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:

Health HazardsExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:

Reactive GroupAlcohols and Polyols

Reactivity Profile · 1건

N,N-DIISOPROPYL ETHANOLAMINE is an amino alcohol. Neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated in combination with strong reducing agents, such as hydrides.

안전 및 보호

Fire FightingExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:

First AidExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:

Nonfire Spill ResponseExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:

Protective Action Criteria (PAC) · 3건

1.5 [mg/m3]

17 [mg/m3]

99 [mg/m3]

Personal Protective Equipment (PPE)Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:

안전 데이터

wgk: 2
tsca: TSCA listed
rtecs: KK5950000
ridadr: UN 2922 8/PG 2
risk_code: 20/22-24-34
hazard_code: T
safety_code: 26-36/37/39-45
포장분류: III
위험 등급: 3.2
기존화학 물질: KE-03279
F 고인화성물질: 9-23

화학 및 산업

용도 및 제조

General Manufacturing InformationEthanol, 2-[bis(1-methylethyl)amino]-: ACTIVE

응용 분야

용도2-(Diisopropylamino)ethanol is used in method for preparing Fluvardiol catalyzed by carbonyl reductase.

일반 설명A colorless liquid. Slightly soluble in water and less dense than water. Severely irritates skin and eyes. Flash point 175°F. Used to make other chemicals.