1-Cyclopropylpiperazine

HCID 4742004CAS 20327-23-5

기본 정보

표준 SMILES: C1CN(C2CC2)CCN1
InChIKey: HNZJIWIXRPBFAN-UHFFFAOYSA-N
분자식: C7H14N2
평균 분자량: 126.2 g/mol
단동위원소 질량: 126.11569845

이름 및 식별자

우선 이름: 1-Cyclopropylpiperazine
IUPAC: 1-cyclopropylpiperazine
영어명: 1-Cyclopropylpiperazine
분자식: C7H14N2
분자량: 126.2

이름 및 동의어

1-Cyclopropylpiperazine20327-23-5DTXSID20406303RefChem:229876DTXCID30357155807-993-7Piperazine, 1-cyclopropyl-MFCD062548051-CYCLOPROPYL-PIPERAZINEcyclopropyl piperazineN-CYCLOPROPYLPIPERAZINE(Piperazin-1-yl)cyclopropane

이름 더 보기

1-Cyclopropylpiperazine >(Piperazin-1-yl)cyclopropane1-(Cyclopropyl Phenyl)Piperazine1-Cyclopropylpiperazine - [C14363]1-Cyclopropylpiperazine ISO 9001：2015 REACH

cyclopropylpiperazinecyclopropylpiper-azinen-cyclopropyl-piperazineN-cyclopropyl piperazinePiperazine,1-cyclopropyl-SCHEMBL63548SCHEMBL188355SCHEMBL894571

데이터베이스 식별자

CAS: 20327-23-5
PubChem CID: 4742004
DTXSID: DTXSID20406303
EC Number: 807-993-7

물성

구조 계산 물성

XLogP: 0.2
극성 표면적: 15.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 93.1

물리화학적 성질

끓는 점: 43 °C/7mm · 43°C/7mm
밀도: 0.94 · 0.94
굴절률: 1.4804 · 1.4804
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
물리적 상태: 투명한 액체
산도 계수 (pKa): 9.23 · 9.23±0.10(Predicted)
색상: 무색~연황색
InChI: InChI=1S/C7H14N2/c1-2-7(1)9-5-3-8-4-6-9/h7-8H,1-6H2
InChIKey: HNZJIWIXRPBFAN-UHFFFAOYSA-N
SMILES: N1(C2CC2)CCNCC1

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (60%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, 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, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

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

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (60%)

안전 데이터

ridadr: 3267
HS 번호: 2933599590
hazard_code: Xi
포장분류: Ⅲ
위험 등급: 8

화학 및 산업

응용 분야 · 1건

용도1-cyclopropylpiperazine is a piperazine derivative known in the literature by synonyms such as N-cyclopropylpiperazine and 4-cyclopropylpiperazine. It has been used in the preparation of some tri- and tetrasubstituted ureas with histamine H3 antagonist receptor activity, 3-amido-4- anilinoquinolines series as CSF-1R kinase inhibitors, for the synthesis of cyclopropyl amines as modulators of the histamine H3 receptor, sulfonamide compounds as cysteine protease inhibitors, N-oxides as antibacterial agents and in the treatment of the disease caused by helicobacter infection[1].