2-Piperazinylpyrimidine dihydrochloride

HCID 11680272CAS 94021-22-4

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Grundinformationen

Standard-SMILES: Cl.Cl.c1cnc(N2CCNCC2)nc1
InChIKey: ZNZGJSLHXOMREP-UHFFFAOYSA-N
Summenformel: C8H14Cl2N4
Durchschnittliche Molmasse: 237,13 g/mol
Monoisotopische Masse: 236,05955181

Namen und Bezeichner

Bevorzugter Name: 2-Piperazinylpyrimidine dihydrochloride
IUPAC: 2-piperazin-1-ylpyrimidine;dihydrochloride

Namen und Synonyme

94021-22-42-Piperazinylpyrimidine dihydrochloride2-Piperazinylpyrimidine HClEINECS 301-415-2DTXSID70240234RefChem:89124DTXCID70162725301-415-22-(1-Piperazinyl)pyrimidine dihydrochloride1-(2-PYRIMIDYL)PIPERAZINE DIHYDROCHLORIDE2-(Piperazin-1-yl)pyrimidine dihydrochloride1-(2-pyrimidinyl)piperazine dihydrochloride

Weitere Namen anzeigen

2-piperazin-1-ylpyrimidine DihydrochlorideMFCD000127792-piperazin-1-ylpyrimidine;dihydrochloridePyrimidine, 2-(1-piperazinyl)-, dihydrochloride2-(1-PIPERAZINYL)PYRIMIDINE 2HCL1-(2-pyrimidyl) piperazine dihydrochloride1-(2-Pyrimidyl)-piperazine dihydrochlorideN-(2-pyrimidinyl)piperazine dihydrochloride

Datenbank-Bezeichner

CAS: 94021-22-4
PubChem CID: 11680272
DTXSID: DTXSID70240234
UNII: SLC2P2PLG8
EC Number: 301-415-2

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 41,1 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 1
Schwere Atome: 14
Formalladung: 0
Komplexität: 127

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.