1-(3-플루오로페닐)피페라진

1-(3-Fluorophenyl)piperazine

HCID 77418CAS 3801-89-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Fc1cccc(N2CCNCC2)c1
InChIKey: KIFCSMQTGWVMOD-UHFFFAOYSA-N
분자식: C10H13FN2
평균 분자량: 180.22 g/mol
단동위원소 질량: 180.10627664

이름 및 식별자

우선 이름: 1-(3-Fluorophenyl)piperazine
IUPAC: 1-(3-fluorophenyl)piperazine
현지명: 1-(3-플루오로페닐)피페라진
영어명: 1-(3-Fluorophenyl)piperazine
분자식: C10H13FN2
분자량: 180.22

이름 및 동의어

1-(3-Fluorophenyl)piperazine3801-89-6Piperazine, 1-(3-fluorophenyl)-B46UBR8BEEEINECS 223-271-9N-(3-Fluorophenyl)piperazineDTXSID401914261-(M-FLUOROPHENYL)PIPERAZINEPIPERAZINE, 1-(M-FLUOROPHENYL)-RefChem:423859DTXCID50113917223-271-9

이름 더 보기

1-(3-플루오로페닐)피페라진1-(3-Fluorophenyl)piperazine97%1-(3-Fluorophenyl)piperazine 97%1-(3-Fluorophenyl)piperazine ,98%

Piperazine,1-(3-fluorophenyl)-1-(3-fluorophenyl)-piperazineC10H13FN2MFCD03412122CHEMBL2697841-(3-Fluoro-phenyl)-piperazine3-fluorophenyl piperazineUNII-B46UBR8BEE

데이터베이스 식별자

CAS: 3801-89-6
PubChem CID: 77418
DTXSID: DTXSID40191426
ChEMBL: CHEMBL269784
UNII: B46UBR8BEE
EC Number: 223-271-9
Nikkaji: J217.688B

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 15.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 157

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds

물리화학적 성질

끓는 점: 88 · 88-91°C 0,2mm
밀도: 1.112 · 1.112±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C, protect from light
산도 계수 (pKa): 8.85 · 8.85±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+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 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

risk_code: 20/21/22-36/37/38-52-22
hazard_code: Xi,Xn
safety_code: 26-36/37/39
위험 참고 사항: Irritant

화학 및 산업

응용 분야

용도1-(3-Fluorophenyl)-piperazine is a Piperazine (P480100) derivative. Piperazine Dihydrochloride is an anthelmintic agent used in the treatment of parasitic worms in animals.