1-[3-(1-피롤리디노)프로필]피페라진

1-(3-Pyrrolidinopropyl)Piperazine

HCID 2737252CAS 224309-80-2

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: C1CCN(CCCN2CCNCC2)C1
InChIKey: JAXVYOQQRAMPQD-UHFFFAOYSA-N
분자식: C11H23N3
평균 분자량: 197.32 g/mol
단동위원소 질량: 197.18919775

이름 및 식별자

우선 이름: 1-(3-Pyrrolidinopropyl)Piperazine
IUPAC: 1-(3-pyrrolidin-1-ylpropyl)piperazine
현지명: 1-[3-(1-피롤리디노)프로필]피페라진
영어명: 1-[3-(1-Pyrrolidino)propyl]piperazine
분자식: C11H23N3
분자량: 197.32

이름 및 동의어

224309-80-21-(3-Pyrrolidinopropyl)PiperazineDTXSID20371946RefChem:224610DTXCID803229791-(3-(pyrrolidin-1-yl)propyl)piperazine1-(3-pyrrolidin-1-ylpropyl)piperazine1-[3-(pyrrolidin-1-yl)propyl]piperazine1-[3-(1-pyrrolidino)propyl]piperazineMFCD013208951-(3-pyrrolidinopropyl)-piperazine1-[3-(1-pyrrolidinyl)propyl]piperazine

이름 더 보기

1-[3-(1-피롤리디노)프로필]피페라진Piperazine, 1-[3-(1-pyrrolidinyl)propyl]-1-[3-(Pyrrolidin-1-yl)prop-1-yl]piperazine97%1-[3-(Pyrrolidin-1-yl)prop-1-yl]piperazine 97%

1-[3-(Pyrrolidin-1-yl)prop-1-yl]piperazineSCHEMBL42822SCHEMBL1934187JAXVYOQQRAMPQD-UHFFFAOYSA-NAKOS009158646PS-58331-(3-pyrrolidin-1-yl-propyl)-piperazineBP-11363

데이터베이스 식별자

CAS: 224309-80-2
PubChem CID: 2737252
DTXSID: DTXSID20371946
EC Number: 671-054-6

물성

구조 계산 물성

XLogP: 0.5
극성 표면적: 18.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 14
형식 전하: 0
복잡도: 149

물리화학적 성질

끓는 점: 106 · 106-108
밀도: 0.969 · 0.969±0.06 g/cm3(Predicted)
산도 계수 (pKa): 10.39 · 10.39±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 2 reports by companies from 2 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

Hazard Classes and CategoriesAcute Tox. 4 (50%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (50%)；Eye Irrit. 2 (50%)；Acute Tox. 4 (50%)；STOT SE 3 (100%)