N-(4-bromo-2-nitrophenyl)acetamide

HCID 136690CAS 881-50-5

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Grundinformationen

Standard-SMILES: CC(=O)Nc1ccc(Br)cc1[N+](=O)[O-]
InChIKey: GUBNCRISSRANNO-UHFFFAOYSA-N
Summenformel: C8H7BrN2O3
Durchschnittliche Molmasse: 259,06 g/mol
Monoisotopische Masse: 257,964

Namen und Bezeichner

Bevorzugter Name: N-(4-bromo-2-nitrophenyl)acetamide
IUPAC: N-(4-bromo-2-nitrophenyl)acetamide
Englischer Name: 4'-BROMO-2'-NITROACETANILIDE
Summenformel: C8H7BrN2O3
Molmasse: 259.06

Namen und Synonyme

N-(4-Bromo-2-nitrophenyl)acetamide881-50-5RefChem:827218618-120-24'-Bromo-2'-nitroacetanilide4-Bromo-2-nitroacetanilideMFCD00024299Acetamide, N-(4-bromo-2-nitrophenyl)-4//'-Bromo-2//'-nitroacetanilideN-(4-bromo-2-nitro-phenyl)-acetamideN-(2-Nitro-4-bromophenyl)acetamideNSC142293

Weitere Namen anzeigen

N-(4-bromo-2-nitro-phenyl)ethanamide

N-(4-bromo-2-nitro-phenyl)acetamide2-Nitro-4-bromacetanilidN-(4-Bromo-2-nitrophenyl)SCHEMBL978546SCHEMBL31331661DTXSID10236818N-Acetyl 4-bromo-2-nitroanilineALBB-023629

Datenbank-Bezeichner

CAS: 881-50-5
PubChem CID: 136690
DTXSID: DTXSID10236818
EC Number: 618-120-2
Nikkaji: J89.925I

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 74,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 14
Formalladung: 0
Komplexität: 241

Physikochemische Eigenschaften

Schmelzpunkt: 102 · 102-104°C
Siedepunkt: 416.8 · 416.8±35.0 °C(Predicted)
Dichte: 1.72 · 1.720±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: 12.96 · 12.96±0.70(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H317 (97.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 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.