1-(3-Chlorophenyl)piperazine monohydrochloride

HCID 25681CAS 13078-15-4

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Grundinformationen

Standard-SMILES: Cl.Clc1cccc(N2CCNCC2)c1
InChIKey: MHXPYWFZULXYHT-UHFFFAOYSA-N
Summenformel: C10H14Cl2N2
Durchschnittliche Molmasse: 233,13 g/mol
Monoisotopische Masse: 232,05340381

Namen und Bezeichner

Bevorzugter Name: 1-(3-Chlorophenyl)piperazine monohydrochloride
IUPAC: 1-(3-chlorophenyl)piperazine;hydrochloride

Namen und Synonyme

1-(3-Chlorophenyl)piperazine monohydrochlorideRefChem:743161-(3-Chlorophenyl)piperazine hydrochloride13078-15-465369-76-81-(M-CHLOROPHENYL)PIPERAZINE HYDROCHLORIDE1-(3-Chlorophenyl)piperazinium chloride1-(m-Chlorophenyl)piperazine HClPiperazine, 1-(3-chlorophenyl)-, monohydrochloride1-(3-Chlorophenyl)piperazine HCl1-(3-chlorophenyl)piperazine;hydrochloride7IM2GS7ILV

Weitere Namen anzeigen

m-CPP hydrochlorideNSC-134746Chlorophenyl Piperazine Hydrochloride SaltTrazodone Impurity 61-(3-Chlorophenyl)-piperazine.HCl(3-chlorophenyl)piperazine, chloridem-chlorophenylpiperazine hydrochlorideSMR000875230

Datenbank-Bezeichner

CAS: 13078-15-4、51639-49-7、65369-76-8
PubChem CID: 25681
DTXSID: DTXSID40896823
ChEMBL: CHEMBL1256321
UNII: 7IM2GS7ILV
EC Number: 235-976-9、265-718-0

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 15,3 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 14
Formalladung: 0
Komplexität: 157

Experimentelle und physikochemische Eigenschaften

Solubility>35 [ug/mL] (The mean of the results at pH 7.4)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Warning

H302 (97.7%): 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 43 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

Gefahrenhinweise

Hazard Classes and Categories · 2 Einträge

Acute Tox. 4 (97.7%)

Acute Tox. 3 (100%)

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological ClassificationEndogenous compounds and drugs that bind to and activate SEROTONIN RECEPTORS. Many serotonin receptor agonists are used as ANTIDEPRESSANTS; ANXIOLYTICS; and in the treatment of MIGRAINE DISORDERS.