1-Aminofluoren-9-one

HCID 80664

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Grundinformationen

CAS: 6344-62-3
Standard-SMILES: Nc1cccc2c1C(=O)c1ccccc1-2
InChIKey: KSEPMOMKAQKOSM-UHFFFAOYSA-N
Summenformel: C13H9NO
Durchschnittliche Molmasse: 195,22 g/mol
Monoisotopische Masse: 195,06841391

Namen und Bezeichner

Bevorzugter Name: 1-Aminofluoren-9-one
IUPAC: 1-aminofluoren-9-one
Englischer Name: 1-Amino-9-fluorenone
Summenformel: C13H9NO
Molmasse: 195.22

Namen und Synonyme

1-Aminofluoren-9-oneEINECS 228-748-5KSEPMOMKAQKOSM-UHFFFAOYSA-DTXSID30212856NSC 51311RefChem:429427DTXCID60135347228-748-5InChI=1/C13H9NO/c14-11-7-3-6-9-8-4-1-2-5-10(8)13(15)12(9)11/h1-7H,14H21-Amino-9H-fluoren-9-one6344-62-31-Amino-9-fluorenone

Weitere Namen anzeigen

one, 1-Einecs 228-748-51-amino-9H-fluoren-9-one HCL

MFCD000011589H-Fluoren-9-one, 1-amino-C5CL9U2GZY1-Aminofluoren-9-on1-Amino-fluoren-9-oneMaybridge1_002094UNII-C5CL9U2GZYFluoren-9-one, 1-amino-

Datenbank-Bezeichner

CAS: 6344-62-3
PubChem CID: 80664
DTXSID: DTXSID30212856
ChEMBL: CHEMBL1241133
UNII: C5CL9U2GZY
EC Number: 228-748-5
Nikkaji: J81.196C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,5
Polarare Oberfläche (TPSA): 43,1 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 15
Formalladung: 0
Komplexität: 276

Physikochemische Eigenschaften

Schmelzpunkt: 118 · 118-120 °C (lit.)
Siedepunkt: 406.2 · 406.2±24.0 °C(Predicted)
Dichte: 1.327 · 1.327±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
pka: 0.44 · 0.44±0.20(Predicted)
Aggregatzustand: powder

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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 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.