4-Phenylpiperidiniumchlorid

4-Phenylpiperidinium chloride

HCID 82509

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Grundinformationen

CAS: 10272-49-8
Standard-SMILES: Cl.c1ccc(C2CCNCC2)cc1
InChIKey: UPZJLQCUYUTZIE-UHFFFAOYSA-N
Summenformel: C11H16ClN
Durchschnittliche Molmasse: 197,7 g/mol
Monoisotopische Masse: 197,09712719

Namen und Bezeichner

Bevorzugter Name: 4-Phenylpiperidinium chloride
IUPAC: 4-phenylpiperidine;hydrochloride
Lokaler Name: 4-Phenylpiperidiniumchlorid
Englischer Name: 4-Phenylpiperidine hydrochloride
Summenformel: C11H16ClN
Molmasse: 197.7

Namen und Synonyme

4-phenylpiperidine hydrochloride10272-49-84-Phenylpiperidinium chlorideEINECS 233-617-0DTXSID20145467RefChem:526448DTXCID7067958233-617-04-Phenyl-piperidine hydrochlorideMFCD016325274-PHENYL-PIPERIDINE HCL4-phenylpiperidine;hydrochloride

Weitere Namen anzeigen

4-Phenylpiperdine hydrochloridePiperidine, 4-phenyl-,hydrochloride (1:1)1,2,3,6-Tetrahydro-4-phenylpiperidine hydrochloride

Piperidine, 4-phenyl-, hydrochloride (1:1)4-phenylpiperidinehydrochlorideCHEMBL20115464-Phenyl piperidine hydrochloride4-phenylpiperdine hclorb3029600SCHEMBL14816334-phenyl-piperidin hydrochloride

Datenbank-Bezeichner

CAS: 10272-49-8
PubChem CID: 82509
DTXSID: DTXSID20145467
ChEMBL: CHEMBL2011546
EC Number: 233-617-0

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 12 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 121

Physikochemische Eigenschaften

Schmelzpunkt: 164 · 164-165℃
storage temp.: Inert atmosphere,Room Temperature
InChI: InChI=1S/C11H15N.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h1-5,11-12H,6-9H2;1H
InChIKey: UPZJLQCUYUTZIE-UHFFFAOYSA-N
SMILES: C1(C=CC=CC=1)C1CCNCC1.Cl

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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.