2-Amino-1-(4-bromophenyl)ethan-1-one hydrochloride

HCID 2798216CAS 5467-72-1

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Grundinformationen

Standard-SMILES: Cl.NCC(=O)c1ccc(Br)cc1
InChIKey: ROAVTVXTYFSQEA-UHFFFAOYSA-N
Summenformel: C8H9BrClNO
Durchschnittliche Molmasse: 250,52 g/mol
Monoisotopische Masse: 248,9556

Namen und Bezeichner

Bevorzugter Name: 2-Amino-1-(4-bromophenyl)ethan-1-one hydrochloride
IUPAC: 2-amino-1-(4-bromophenyl)ethanone;hydrochloride

Namen und Synonyme

2-Amino-1-(4-bromophenyl)ethan-1-one hydrochlorideRefChem:463133226-778-35467-72-14-Bromophenacylamine hydrochloride2-Amino-4'-bromoacetophenone hydrochloride2-amino-1-(4-bromophenyl)ethanone HydrochlorideMFCD000519982-AMINO-4-BROMOACETOPHENONE HYDROCHLORIDEEthanone, 2-amino-1-(4-bromophenyl)-, hydrochloride2-Amino-4'-bromoacetophenone HCl2-Amino-4'-Bromoacetophenone hydrochloride;2-Amino-4'-Bromoacetophenone hydrochloride

Weitere Namen anzeigen

CHEMBL18016132-amino-1-(4-bromophenyl)ethan-1-one, chloride2-Amino-1-(4-bromophenyl)ethan-1-one Hydrochloride; 2-Amino-1-(4-bromophenyl)ethanone Hydrochloride; N-p-Bromophenacylamine Hydrochloride; a-Amino-p-bromoacetophenone HydrochlorideSCHEMBL203985p-bromophenacylamine hydrochlorideDTXSID601364900NSC25405CCG-45828

Datenbank-Bezeichner

CAS: 5467-72-1
PubChem CID: 2798216
DTXSID: DTXSID601364900
ChEMBL: CHEMBL1801613
EC Number: 226-778-3

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 43,1 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 12
Formalladung: 0
Komplexität: 141

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 2.1% (1 of 47) of reports.

Warning

H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.7%): 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 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 47 reports by companies.；There are 6 notifications provided by 46 of 47 reports by companies with hazard statement code(s).；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.