5-Chloro-1H-indole-3-ethylamine monohydrochloride

HCID 2827494CAS 55747-73-4

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Grundinformationen

Standard-SMILES: Cl.NCCc1c[nH]c2ccc(Cl)cc12
InChIKey: PBANXRNIXGEHPZ-UHFFFAOYSA-N
Summenformel: C10H12Cl2N2
Durchschnittliche Molmasse: 231,12 g/mol
Monoisotopische Masse: 230,0377538

Namen und Bezeichner

Bevorzugter Name: 5-Chloro-1H-indole-3-ethylamine monohydrochloride
IUPAC: 2-(5-chloro-1H-indol-3-yl)ethanamine;hydrochloride

Namen und Synonyme

EINECS 213-387-85-Chloro-1H-indole-3-ethylamine monohydrochloride1H-Indole-3-ethanamine, 5-chloro-, hydrochloride (1:1)RefChem:534328213-387-85-Chlorotryptamine Hydrochloride942-26-72-(5-chloro-1H-indol-3-yl)ethanamine hydrochloride2-(5-chloro-1H-indol-3-yl)ethanamine;hydrochloride55747-73-4MFCD000519905-Chloro-1H-indole-3-ethylamine hydrochloride

Weitere Namen anzeigen

1H-Indole-3-ethanamine, 5-chloro-, monohydrochloride5-Chloro-3-(2-aminoethyl)indole Hydrochloride5-Chloro-1H-indole-3-ethylamine HCl2-(5-chloro-1H-indol-3-yl)ethan-1-amine hydrochloride5-Chlorotryptamine HCl5-chlorotryptamine, hclEINECS 259-789-7BIM-0013443.P001

Datenbank-Bezeichner

CAS: 55747-73-4、942-26-7
PubChem CID: 2827494
DTXSID: DTXSID60971121
UNII: FD7RS43ALK
EC Number: 213-387-8、259-789-7

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 41,8 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 14
Formalladung: 0
Komplexität: 174

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (11.1%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (88.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (88.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (77.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 9 reports by companies from 5 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.