Indobufen
Bezeichnung:Indobufen
CAS-Nr63610-08-2
Englisch Name:Indobufen
CBNumberCB6213695
SummenformelC18H17NO3
Molgewicht295.34
MOL-Datei63610-08-2.mol
Indobufen physikalisch-chemischer Eigenschaften
Schmelzpunkt | 182-184° |
Siedepunkt | 518.1±50.0 °C(Predicted) |
Dichte | 1.275±0.06 g/cm3(Predicted) |
storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
Aggregatzustand | Solid |
pka | 4.39±0.10(Predicted) |
Farbe | White |
InChI | InChI=1S/C18H17NO3/c1-2-15(18(21)22)12-7-9-14(10-8-12)19-11-13-5-3-4-6-16(13)17(19)20/h3-10,15H,2,11H2,1H3,(H,21,22) |
InChIKey | AYDXAULLCROVIT-UHFFFAOYSA-N |
SMILES | O=C1C2C=CC=CC=2CN1C1C=CC(C(CC)C(=O)O)=CC=1 |
CAS Datenbank | 63610-08-2(CAS DataBase Reference) |
EPA chemische Informationen | Benzeneacetic acid, 4-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-.alpha.-ethyl- (63610-08-2) |