피페리딘에탄올

N-Piperidinoethanol

HCID 18232CAS 3040-44-6
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
OCCN1CCCCC1
InChIKey
KZTWONRVIPPDKH-UHFFFAOYSA-N
분자식
C7H15NO
평균 분자량
129.2 g/mol
단동위원소 질량
129.1153641

개요

2-(piperidin-1-yl)ethanol is a member of the class of piperidine in which the hydrogen attached to the nitrogen atom is substituted by a 2-hydroxyethyl group. It is a primary alcohol, a member of ethanolamines, a member of piperidines and a tertiary amino compound.

이름 및 식별자

우선 이름
N-Piperidinoethanol
IUPAC
2-piperidin-1-ylethanol
현지명
피페리딘에탄올
영어명
2-Piperidinoethanol
분자식
C7H15NO
분자량
129.2

이름 및 동의어

3040-44-62-Piperidinoethanol1-(2-Hydroxyethyl)piperidine1-PIPERIDINEETHANOLN-PiperidinoethanolN-Piperidineethanolbeta-Piperidinoethanol.beta.-PiperidinoethanolNSC 3460EINECS 221-244-6VR81F07RX51-Oxa-4-azaspiro(3.5)nonane (VAN)
이름 더 보기
피페리딘에탄올1-피페리딘에탄올2-피페리디노에탄올PPOHAKOS BBS-00004365PIPERIDINOETHANOLBUTTPARK 154\16-412-PIPERIDINETHANOLβ-Piperidylethanol
BRN 0103390AI3-11737NSC-34605-20-02-00101 (Beilstein Handbook Reference)DTXSID40628081-Oxa-4-azaspiro(3.5)nonane1-Oxa-4-azaspiro[3.5]nonaneRefChem:831031

데이터베이스 식별자

CAS
3040-44-6
PubChem CID
18232
DTXSID
DTXSID4062808
ChEMBL
CHEMBL118227
ChEBI
CHEBI:61238
UNII
VR81F07RX5
EC Number
221-244-6
Nikkaji
J205.348I

물성

구조 계산 물성

XLogP
1
극성 표면적
23.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
2
무거운 원자 수
9

실험 및 물리화학적 성질

SpringerMaterials PropertiesChemical shift
Physical DescriptionLiquid

물리화학적 성질

녹는점
16 °C · 16°C
끓는 점
199 · 199-202 °C (lit.)
밀도
0.973 g/mL · 0.973 g/mL at 25 °C (lit.)
증기압
1.3 hPa · 1.3 hPa @ 40°C
굴절률
20 · n20/D 1.4804(lit.)
인화점
156 °F · 156 °F

화학적 성질

Clear Colourless Liquid

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H302+H312 (62.7%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]

P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 166 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H227: Combustible liquid [Warning Flammable liquids]

유해성 정보

Regulatory Information · 2건

1-Piperidineethanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Piperidineethanol 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: 30-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/26699

Hazard Classes and Categories · 2건

Acute Tox. 4 (100%)

Flammable liquids - Category 4

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
TM8052000
ridadr
UN2735
독성
cat,LDLo,oral,250mg/kg (250mg/kg),BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD,Journal of Pharmacology and Experimental Therapeutics. Vol. 55, Pg. 419, 1935.
HS 번호
29333999

화학 및 산업

용도 및 제조

U.S. Production2023: <50,000 lb
Industry UsespH regulating agent
General Manufacturing Information · 2건

Petroleum Lubricating Oil and Grease Manufacturing

1-Piperidineethanol: ACTIVE

응용 분야

용도1-Piperidineethanol (cas# 3040-44-6) is a compound useful in organic synthesis.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

추가 설명

정의ChEBI: A member of the class of piperidine in which the hydrogen attached to the nitrogen atom is substituted by a 2-hydroxyethyl group.

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117건
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