1-(3-Fluorphenyl)piperazin

1-(3-Fluorophenyl)piperazine

HCID 77418CAS 3801-89-6

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Grundinformationen

Standard-SMILES: Fc1cccc(N2CCNCC2)c1
InChIKey: KIFCSMQTGWVMOD-UHFFFAOYSA-N
Summenformel: C10H13FN2
Durchschnittliche Molmasse: 180,22 g/mol
Monoisotopische Masse: 180,10627664

Namen und Bezeichner

Bevorzugter Name: 1-(3-Fluorophenyl)piperazine
IUPAC: 1-(3-fluorophenyl)piperazine
Lokaler Name: 1-(3-Fluorphenyl)piperazin
Englischer Name: 1-(3-Fluorophenyl)piperazine
Summenformel: C10H13FN2
Molmasse: 180.22

Namen und Synonyme

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

Weitere Namen anzeigen

1-(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

Datenbank-Bezeichner

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

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,2
Polarare Oberfläche (TPSA): 15,3 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 157

Experimentelle und physikochemische Eigenschaften

DrugsPharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds

Physikochemische Eigenschaften

Siedepunkt: 88 · 88-91°C 0,2mm
Dichte: 1.112 · 1.112±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C, protect from light
pka: 8.85 · 8.85±0.10(Predicted)
CAS Datenbank: 3801 · 3801-89-6(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Sicherheitsdaten

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

Chemie und Industrie

Anwendungen

Verwenden1-(3-Fluorophenyl)-piperazine is a Piperazine (P480100) derivative. Piperazine Dihydrochloride is an anthelmintic agent used in the treatment of parasitic worms in animals.