Benorilat
Bezeichnung:Benorilat
CAS-Nr5003-48-5
Englisch Name:BENORILATE
CBNumberCB2397764
SummenformelC17H15NO5
Molgewicht313.3
MOL-Datei5003-48-5.mol
Synonyma
Benorilat
Benorilat physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 177-181℃ |
| Siedepunkt | 453.11°C (rough estimate) |
| Dichte | 1.2016 (rough estimate) |
| Brechungsindex | 1.4500 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
| pka | 14.17±0.70(Predicted) |
| Aggregatzustand | Solid |
| Farbe | White |
| Wasserlöslichkeit | 20mg/L(21 ºC) |
| Merck | 14,1045 |
| InChI | InChI=1S/C17H15NO5/c1-11(19)18-13-7-9-14(10-8-13)23-17(21)15-5-3-4-6-16(15)22-12(2)20/h3-10H,1-2H3,(H,18,19) |
| InChIKey | FEJKLNWAOXSSNR-UHFFFAOYSA-N |
| SMILES | C(OC1=CC=C(NC(C)=O)C=C1)(=O)C1=CC=CC=C1OC(C)=O |
| CAS Datenbank | 5003-48-5(CAS DataBase Reference) |
| RTECS-Nr. | VO0720000 |
| HS Code | 2924.29.7790 |
| Toxizität | LD50 in mice, rats (mg/ml): 2000, ~10000 orally; 1255, 1830 i.p. (Robertson) |
