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N,N-다이아이소프로필에틸아민

Diisopropylethylamine

HCID 81531
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기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
7087-68-5
표준 SMILES
CCN(C(C)C)C(C)C
InChIKey
JGFZNNIVVJXRND-UHFFFAOYSA-N
분자식
C8H19N
평균 분자량
129.24 g/mol
단동위원소 질량
129.15174961

이름 및 식별자

우선 이름
Diisopropylethylamine
IUPAC
N-ethyl-N-propan-2-ylpropan-2-amine
현지명
N,N-다이아이소프로필에틸아민
영어명
N,N-Diisopropylethylamine
분자식
C8H19N
분자량
129.24

이름 및 동의어

N,N-Diisopropylethylamine7087-68-5EthyldiisopropylamineDiisopropylethylamineN-EthyldiisopropylaminedieaDIPEAHunig's Base2-Propanamine, N-ethyl-N-(1-methylethyl)-1,1'-Dimethyltriethylamine5SIQ15721LNSC-147491
이름 더 보기
N,N-다이아이소프로필에틸아민N,N-디이소프로필에틸아민N-에틸-N-(1-메틸에틸)-2-프로판아민N,N-다이아이소프로필에틸아민(N,N-DIISOPROPYLETHYLAMINE)DIEPAi-Pr2NEt
DTXSID8064561RefChem:161220DTXCID3046829230-392-0N-ethyl-N-isopropylpropan-2-amineethylbis(propan-2-yl)amineN-Ethyl-N,N-diisopropylamineN-ethyl-N-propan-2-ylpropan-2-amine

데이터베이스 식별자

CAS
7087-68-5
PubChem CID
81531
DTXSID
DTXSID8064561
ChEBI
CHEBI:193590
UNII
5SIQ15721L
EC Number
230-392-0
Nikkaji
J108.742H

물성

구조 계산 물성보충 중

XLogP
2.2
극성 표면적
3.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
3
무거운 원자 수
9
형식 전하
0
복잡도
59

실험 및 물리화학적 성질

Density0.742 @25 °C
Boiling Point126.5 °C @760 [mm Hg]
Vapor Pressure12.0 [mmHg]
Physical DescriptionClear colorless liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점
50 to · −50 to −46 °C (−58 to −51 °F; 223 to 227 K)
끓는 점
126.6 °C; · 126.6 °C; 259.8 °F; 399.7 K
밀도
0.742 g · 0.742 g mL−1
증기압
31 mmHg · 31 mmHg ( 37.7 °C)
굴절률
1.414 · 1.414
인화점
10 °C · 10 °C (50 °F; 283 K)
저장 조건
30 °C · Store below +30°C.
용해도
물과 섞임
산도 계수 (pKa)
10.98 · 10.98±0.28(Predicted)
물리적 상태
liquid
색상
Colorless
Specific Gravity

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for < 0.1% (1 of 2527) of reports.

Danger

H225 (97.8%): Highly Flammable liquid and vapor [Danger Flammable liquids];H302 (92.3%): Harmful if swallowed [Warning Acute toxicity, oral];H318 (96.4%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H331 (91.3%): Toxic if inhaled [Danger Acute toxicity, inhalation];H335 (91.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2527 reports by companies from 28 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 2527 reports by companies.;There are 27 notifications provided by 2526 of 2527 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information · 4건

Chemical: 2-Propanamine, N-ethyl-N-(1-methylethyl)-

2-Propanamine, N-ethyl-N-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propanamine, N-ethyl-N-(1-methylethyl)- 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: 01-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13609;Status: Active Update: 24-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/28157

2-Propanamine, N-ethyl-N-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard

화학 및 산업

용도 및 제조

Uses · 2건

Used to make and/or formulate industrial products; [BASF MSDS]

Synthetic Polymer MALDI Matrix Compounds

U.S. Production2022: 50,000 - <250,000 lb;2021: 50,000 - <250,000 lb;2020: 50,000 - <250,000 lb
Industry UsesIntermediate
General Manufacturing Information · 2건

All Other Basic Organic Chemical Manufacturing

2-Propanamine, N-ethyl-N-(1-methylethyl)-: ACTIVE

응용 분야 · 2건

용도N,N-Diisopropylethylamine is used as a base in organic reactions. Used in the preparation of (-)Gambierol a marine polycyclic ether toxin. It is also used in the synthesis of potent inhibitors of human brain memapsin, a key effector in the progression of Alzheimer’s disease.

일반 설명N-Ethyldiisopropylamine (EDIA) reacts with monoactivated Michael acceptors to afford symmetrical sulfones.

제조 방법 · 1건

N,N-Diisopropylethylamine is used as a non-nucleophilic base in organic synthesis. It is prepared by the alkylation of diisopropylamine with diethyl sulphate. DIPEA can then be purified through distillation from potassium hydroxide if necessary.

상·하류 제품 정보

하류 제품

3-Azetidinecarboxylic acid6-Chloro-5-nitropyrimidin-4-aminetert-Butyl N-(benzyloxy)carbamate

관련 반응

107,525건
반응 기록 만들기
HRID 883 반응식
HRID 883반응물로uspto-grants-1998_03
HRID 893 반응식
HRID 893반응물로uspto-grants-1998_03
HRID 897 반응식
HRID 897반응물로uspto-grants-1998_03
HRID 1379 반응식
HRID 1379반응물로uspto-grants-1998_03
HRID 1557 반응식
HRID 1557반응물로uspto-grants-1998_03
HRID 1714 반응식
HRID 1714반응물로uspto-grants-1998_03
HRID 2239 반응식
HRID 2239반응물로uspto-grants-1998_03
HRID 2907 반응식
HRID 2907용매로uspto-grants-1998_03
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화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
더보기
새 노트새 반응견적 요청하기
0.755 · 0.755 (20/4℃)
수소이온지수(pH)
12.3 · 12.3 (H2O, 20℃)(as an emulsion)
폭발한계
0.7 · 0.7-6.3%(V)
수용성
혼용 가능
BRN
605301 · 605301
안정성
휘발성 물질
InChI
1S/C8H19N/c1-6-9(7(2)3)8(4)5/h7-8H,6H2,1-5H3
InChIKey
JGFZNNIVVJXRND-UHFFFAOYSA-N
SMILES
CCN(C(C)C)C(C)C
LogP
-1.8 at · -1.8 at 22.5℃
NIST
(i-C3H7)2(C2H5)N(7087-68-5)
EPA
2 · 2-Propanamine, N-ethyl-N-(1-methylethyl)- (7087-68-5)

화학적 성질

Diisopropylethylamine (DIPEA) is a clear, colorless to light yellow liquid, insoluble in water and easily soluble in acetone and other organic solvents.

Hazards SummaryCauses burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Toxic by ingestion; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesFlam. Liq. 2 (97.8%);Acute Tox. 4 (92.3%);Eye Dam. 1 (96.4%);Acute Tox. 3 (91.3%);STOT SE 3 (91.3%)

안전 및 보호

Protective Action Criteria (PAC) · 3건

1.8 [mg/m3]

19 [mg/m3]

120 [mg/m3]

독성 정보

Adverse EffectsDermatotoxin - Skin burns.;Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors.

규제 정보

Regulatory Information · 4건

Chemical: 2-Propanamine, N-ethyl-N-(1-methylethyl)-

2-Propanamine, N-ethyl-N-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propanamine, N-ethyl-N-(1-methylethyl)- 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: 01-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13609;Status: Active Update: 24-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/28157

2-Propanamine, N-ethyl-N-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk
2
tsca
TSCA listed
ridadr
UN 2734 8/PG 2
독성
LD50 orally in Rabbit: > 200 - 500 mg/kg
HS 번호
29211980
risk_code
11-22-34-52/53-20/21/22-10-41-37/38-20/22-36/37/38-61
hazard_code
C,F,T
safety_code
26-36/37/39-45-61-16-27-60-23-9-53
포장분류
II
위험 등급
3
기존화학 물질
KE-10950
F 고인화성물질
9-34
위험 참고 사항
Highly Flammable/Corrosive/Harmful
자연 발화 온도
240 °C
Hazard Classifications
Acute Tox. 3 InhalationAcute Tox. 4 OralAquatic Chronic 2Eye Dam. 1Flam. Liq. 2STOT SE 3
스토리지 클래스
3 - Flammable liquids
Methyl 3-((piperidin-4-yl)methyl)benzoate
3-(N-Boc-아미노메틸)아제티딘
2-Amino-5-phenyl-thiophene-3-carboxylic acid methyl ester
4-Amino-6-chloropyrimidin-5-ylamine
Faropenem
5-Amino-6-chloro-pyrimidin-4-ol
4-에틸라닐린
4-((1-(tert-부톡시카르보닐)피페리딘-4-일)메틸)벤조산
2-Ethylpiperazine
1-Boc-3-Cyanoazetidine
Methyl 4-((piperidin-4-yl)methyl)benzoate
Piperazine-1,4-dicarboxylic acid tert-butyl ester methyl ester
3-(5-메틸-1,2,4-옥사디아졸-3-일)벤잘데하이드
4-(3-브로모페닐)모르폴린
2-((1-(tert-Butoxycarbonyl)piperidin-4-yl)methyl)benzoic acid
5,6,7,8-테트라히드로피리도[4,3-d]피리미딘-4(3H)-온
5-Amino-4,6-dichloropyrimidine
밥타
1-Boc-3-(Aminomethyl)azetidine
4,6-Dichloro-5-nitropyrimidine
2-(피페라진-1-일)-아세트산N-(2-페닐에틸)-아미드
3-브로모-2-메톡시프로펜
메틸5-니트로-2-푸로에이트
3-[(4-메틸피페라진-1-YL)메틸]벤잘데히드
밥타,테트라나트륨염
4-Chloro-6-hydrazino-pyrimidin-5-ylamine
3-((1-(tert-Butoxycarbonyl)piperidin-4-yl)methyl)benzoic acid
4,5-Diaminopyrimidine
N-(4-FORMYL-PYRIDIN-3-YL)-2,2-디메틸프로피온아미드
(R)-4-Boc-Piperazine-3-carboxylic acid
Methyl 2-((piperidin-4-yl)methyl)benzoate
N-Boc-5,6,7,8-tetrahydro-3-methoxy-[1,2,4]triazolo[4,3-A]pyrazine ,98%
1-Boc-Azetidine-3-yl-methanol
(11aR)-(+)-10,11,12,13-Tetrahydrodiindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin-5-dimethylamine
4-Methoxybenzyl isocyanate
2-(Trifluoromethyl)thiazole-5-carbaldehyde
3-하이드록시메틸-피페라진-1-카르복실산TERT-부틸에스테르