Afloqualone
Bezeichnung:Afloqualone
CAS-Nr56287-74-2
Englisch Name:Afloqualone
CBNumberCB3699964
SummenformelC16H14FN3O
Molgewicht283.3
MOL-Datei56287-74-2.mol
Afloqualone physikalisch-chemischer Eigenschaften
Schmelzpunkt | 195-196°C |
Siedepunkt | 492.5±55.0 °C(Predicted) |
Dichte | 1.2529 (estimate) |
storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
Aggregatzustand | Solid |
pka | 2.73±0.70(Predicted) |
Farbe | White to Off-White |
InChI | InChI=1S/C16H14FN3O/c1-10-4-2-3-5-14(10)20-15(9-17)19-13-7-6-11(18)8-12(13)16(20)21/h2-8H,9,18H2,1H3 |
InChIKey | VDOSWXIDETXFET-UHFFFAOYSA-N |
SMILES | N1C2=C(C=C(N)C=C2)C(=O)N(C2=CC=CC=C2C)C=1CF |
CAS Datenbank | 56287-74-2(CAS DataBase Reference) |