2-(4-Methyl-1-piperazinyl)benzenemethanamine

HCID 2795568

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Grundinformationen

CAS: 655256-68-1
Standard-SMILES: CN1CCN(c2ccccc2CN)CC1
InChIKey: GRSJANZWLLXZFG-UHFFFAOYSA-N
Summenformel: C12H19N3
Durchschnittliche Molmasse: 205,3 g/mol
Monoisotopische Masse: 205,15789762

Namen und Bezeichner

Bevorzugter Name: 2-(4-Methyl-1-piperazinyl)benzenemethanamine
IUPAC: [2-(4-methylpiperazin-1-yl)phenyl]methanamine
Englischer Name: 1-[2-(4-Methylpiperazin-1-yl)phenyl]methanamine
Summenformel: C12H19N3
Molmasse: 205.3

Namen und Synonyme

2-(4-Methyl-1-piperazinyl)benzenemethanamineRefChem:458012655256-68-11-[2-(4-Methylpiperazin-1-yl)phenyl]methanamine(2-(4-methylpiperazin-1-yl)phenyl)methanamine1-(2-Aminomethyl)phenyl-4-methylpiperazine[2-(4-methylpiperazin-1-yl)phenyl]methanamineMFCD04970994Benzenemethanamine, 2-(4-methyl-1-piperazinyl)-[2-(4-Methylpiperazin-1-yl)phenyl]methylamine[2-(4-Methyl-1-piperazinyl)phenyl]methanamineSCHEMBL110927

Weitere Namen anzeigen

AKOS B021975ART-CHEM-BB B0219751-[2-(4-methylpiperazin-1-yl)p2-(4-METHYLPIPERAZINO)BENZYLAMINE2-(4-METHYLPIPERAZIN-1-YL)BENZYLAMINE2-(4-methylpiperazin-1-yl)benze namine2-(4-Methylpiperazin-1-yl)benzylamine 97%1-[2-(4-Methylpiperazin-1-yl)phenyl]methamine

orb3030995SCHEMBL28041538SCHEMBL29505669DTXSID40383788GRSJANZWLLXZFG-UHFFFAOYSA-NFr13064AKOS000261381PS-3674

Datenbank-Bezeichner

CAS: 655256-68-1
PubChem CID: 2795568
DTXSID: DTXSID40383788
EC Number: 638-890-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,7
Polarare Oberfläche (TPSA): 32,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 2
Schwere Atome: 15
Formalladung: 0
Komplexität: 187

Physikochemische Eigenschaften

Aggregatzustand: liquid
Farbe: Clear, almost colourless

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 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.