2-(4-Aminophenyl)acetamide

HCID 238034CAS 6633-76-7

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Grundinformationen

Standard-SMILES: NC(=O)Cc1ccc(N)cc1
InChIKey: PBFBGLBYZHLKHL-UHFFFAOYSA-N
Summenformel: C8H10N2O
Durchschnittliche Molmasse: 150,18 g/mol
Monoisotopische Masse: 150,07931295

Namen und Bezeichner

Bevorzugter Name: 2-(4-Aminophenyl)acetamide
IUPAC: 2-(4-aminophenyl)acetamide
Englischer Name: Benzeneacetamide, 4-amino- (9CI)
Summenformel: C8H10N2O
Molmasse: 150.18

Namen und Synonyme

2-(4-aminophenyl)acetamideDTXSID50285527RefChem:456707DTXCID30236678809-825-86633-76-7Benzeneacetamide, 4-amino- (9CI)4-AMino-benzeneacetaMideBenzeneacetamide, 4-amino-MFCD067963704-aminophenylacetamide(4-aminophenyl)acetamide

Weitere Namen anzeigen

NSC421622-(4-aminophenyl)-acetamideSCHEMBL687483SCHEMBL4605217SCHEMBL6686356PBFBGLBYZHLKHL-UHFFFAOYSA-NGAA63376NSC-42162

Datenbank-Bezeichner

CAS: 6633-76-7
PubChem CID: 238034
DTXSID: DTXSID50285527
EC Number: 809-825-8

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,3
Polarare Oberfläche (TPSA): 69,1 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 11
Formalladung: 0
Komplexität: 139

Physikochemische Eigenschaften

Schmelzpunkt: 161 · 161-162 °C
Siedepunkt: 399.2 · 399.2±25.0 °C(Predicted)
Dichte: 1.198 · 1.198±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C, protect from light
pka: 16.42 · 16.42±0.40(Predicted)
LogP: -0.83 · -0.830 (est)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H317 (97.4%): 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 39 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.