HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Isodictamnine
Isodictamine · Isodictamnine · 9-methylfuro[2,3-b]quinolin-4-one · 9-Methylfuro[2,3-b]quinolin-4(9H)-one · Furo[2,3-b]quinolin-4(9H)-one, 9-methyl-
Identifikatoren & physikalische Daten
| CAS No. | 484-74-2 |
|---|---|
| Summenformel | C12H9NO2 |
| Durchschnittliche Molmasse | 199,2 g/mol |
| Monoisotopische Masse | 199,06332853 g/mol |
| SMILES | Cn1c2ccccc2c(=O)c2ccoc21 |
| InChIKey | FUVCJKNEOUWLPI-UHFFFAOYSA-N |
| PubChem CID | 442913 |
| ChEMBL | CHEMBL509839 |
| ChEBI | CHEBI:6001 |
| DTXSID | DTXSID30332003 |
Chemische & physikalische Eigenschaften
| XLogP | 2,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 33,5 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 15 |
| Formalladung | 0 |
| Komplexität | 279 |
| Schmelzpunkt | 187℃ |
| Siedepunkt | 340.5±21.0 °C(Predicted) |
| Dichte | 1.273±0.06 g/cm3(Predicted) |
| pKa (Säurekonstante) | 0.71±0.20(Predicted) |
Anwendungen & Verwendung
Beschreibung
This quinolone alkaloid was first isolated from the roots of Dictamnus albus and subsequently found in Helietta longifoliata. It is very hygroscopic and turns red on exposure to light. Extraction of the roots under extremely mild conditions show the alkaloid to be a true base and not an artifact of isolation.