1-(p-Tolyl)piperazine dihydrochloride

HCID 83112CAS 13078-14-3

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Grundinformationen

Standard-SMILES: Cc1ccc(N2CCNCC2)cc1.Cl.Cl
InChIKey: PMGFOTNCJZITIM-UHFFFAOYSA-N
Summenformel: C11H18Cl2N2
Durchschnittliche Molmasse: 249,18 g/mol
Monoisotopische Masse: 248,084704

Namen und Bezeichner

Bevorzugter Name: 1-(p-Tolyl)piperazine dihydrochloride
IUPAC: 1-(4-methylphenyl)piperazine;dihydrochloride

Namen und Synonyme

1-(p-Tolyl)piperazine dihydrochloride1-(p-Tolyl)piperazine HClEINECS 235-975-3NSC 71663RefChem:428233235-975-313078-14-31-(4-methylphenyl)piperazine dihydrochloride1-(4-methylphenyl)piperazine;dihydrochloridePiperazine, 1-(4-methylphenyl)-, monohydrochloride4-(4-methylphenyl)piperazine dihydrochloride(4-methylphenyl)piperazine, chloride, chloride

Weitere Namen anzeigen

SCHEMBL3144044-tolylpiperazine dihydrochloridePMGFOTNCJZITIM-UHFFFAOYSA-NDTXSID1013673971-p-tolyl-piperazine dihydrochlorideSBB003157AKOS0159590134-Methylphenyl piperazine dihydrochloride

Datenbank-Bezeichner

CAS: 13078-14-3
PubChem CID: 83112
DTXSID: DTXSID101367397
EC Number: 235-975-3

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 15,3 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 15
Formalladung: 0
Komplexität: 144

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.