1-(2-하이드록시에틸)피페라진
1-(2-Hydroxyethyl)piperazine
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기본 정보
- CAS
103-76-4- 표준 SMILES
OCCN1CCNCC1- InChIKey
WFCSWCVEJLETKA-UHFFFAOYSA-N- 분자식
- C6H14N2O
- 평균 분자량
- 130.19 g/mol
- 단동위원소 질량
- 130.11061307
이름 및 식별자
- 우선 이름
- 1-(2-Hydroxyethyl)piperazine
- IUPAC
- 2-piperazin-1-ylethanol
- 현지명
- 1-(2-하이드록시에틸)피페라진
- 영어명
- 1-(2-Hydroxyethyl)piperazine
- 분자식
- C6H14N2O
- 분자량
- 130.19
이름 및 동의어
N-(2-Hydroxyethyl)piperazine103-76-41-(2-Hydroxyethyl)piperazine1-PIPERAZINEETHANOL2-Piperazin-1-ylethanol2-PiperazinoethanolHydroxyethylpiperazine2-(1-Piperazinyl)ethanol1-Piperazinethanol2-HydroxyethylpiperazineUSAF DO-222-(piperazin-1-yl)ethanol
이름 더 보기
(하이드록시에틸)피페라진1-피페라진에탄올1-(2-하이드록시에틸)피페라진하이드록시에틸피페라진(베타-하이드록시에틸)피페라진1-(베타-하이드록시에틸)피페라진2-(1-피페라진일)에탄올2-(피페라진-1-일)에탄올2-피페라진-1-일에탄올N-(2-하이드록시에틸)피페라진N-(2-히드록시에틸)피페라진2-(Piperazin-1-yl)ethan-1-olN-HYDROXYETHYLPIPERAZINE2-PIPERAZIN-1-YL-ETHANOLHydroxyethylPiperazine /1-PiperazineethanolNSC 60706NSC 38969
4-(2-Hydroxyethyl)piperazineEthanol, 2-(1-piperazinyl)-N-(beta-Hydroxyethyl)piperazine1-(beta-Hydroxyethyl)piperazineNSC 26884CCRIS 6687DTXSID3021853G7VXS31ZFP
데이터베이스 식별자
- CAS
103-76-4- PubChem CID
- 7677
- DTXSID
DTXSID3021853- ChEMBL
CHEMBL3183736- UNII
- G7VXS31ZFP
- EC Number
- 203-142-3
- Nikkaji
- J76.692E
물성
구조 계산 물성보충 중
- XLogP
- -1.1
- 극성 표면적
- 35.5 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 9
- 형식 전하
- 0
- 복잡도
- 71
실험 및 물리화학적 성질
Physical Description
Liquid
Light yellow liquid; [Aldrich MSDS]
Kovats Retention Index1948；1985
Collision Cross Section125.6 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID3021853]；124.7 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID3021853]
물리화학적 성질
- 녹는점
- -38.5 °C · -38.5 °C
- 끓는 점
- 246 °C · 246 °C(lit.)
- 밀도
- 1.061 g/mL · 1.061 g/mL at 25 °C(lit.)
- 증기압
- 0.007 hPa · 0.007 hPa (20 °C)
- 굴절률
- 20 · n20/D 1.506(lit.)
- 인화점
- 230 °F · >230 °F
- 저장 조건
- 30 °C · Store below +30°C.
- 용해도
- 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 기름진 액체
- 산도 계수 (pKa)
- 14.96 · 14.96±0.10(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H315 (80%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (76.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (18.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (19.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 260 reports by companies from 20 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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
Chemical: 1-Piperazineethanol
1-Piperazineethanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Piperazineethanol 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: 06-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19699；Status: Active Update: 26-11-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/21255
2-(1-Piperazinyl) ethanol: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
A moderate eye and mild skin irritant; Causes somnolence, muscle weakness, and muscle contraction or spasticity in oral lethal-dose studies of guinea pigs and rabbits; [RTECS] An irritant; Prolonged or repeated exposure may cause allergic reactions in certain sensitive individuals. [Aldrich MSDS]
화학 및 산업
용도 및 제조
U.S. Production2023: 700,000 - <850,000 lb；2022: 1,000,000 - <5,000,000 lb；2021: 400,000 - <550,000 lb；2020: 100,000 - <250,000 lb
Industry UsesOther；Solvent；Flotation agent；Intermediate；Absorbent
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing；Petroleum Refineries；All Other Basic Organic Chemical Manufacturing；Mining (except Oil and Gas) and support activities
1-Piperazineethanol: ACTIVE
응용 분야
개요1-(2-Hydroxyethyl)piperazine (HEP) is obtained during ethyleneamine production and used for corrosion inhibitors, pharmaceuticals, surfactants, and synthetic fibers.
용도1-(2-Hydroxyethyl)piperazine is a hydroxyalkyl substituted pieprazine used in the preparation of pharmaceutical compounds such as neuroleptic agents.
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