HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 55432Erstellt: 3. November 2026
7-Methyl-5H-furo(3',2':6,7)(1)benzopyrano(3,4-c)pyridin-5-one
7-METHYLPYRIDOPSORALEN · 7-METHYLPYRIDO(3,4-C)PSORALEN · pyrido(3,4-c)-7-methylpsoralen
https://huagongshe.com/de/chemical/55432
Identifikatoren & physikalische Daten
| CAS No. | 85878-63-3 |
|---|
| Summenformel | C15H9NO3 |
|---|
| Durchschnittliche Molmasse | 251,24 g/mol |
|---|
| Monoisotopische Masse | 251,05824315 g/mol |
|---|
| SMILES | Cc1c2occc2cc2c1oc(=O)c1cnccc12 |
|---|
| InChIKey | HUAHUHGFYQDAJK-UHFFFAOYSA-N |
|---|
| PubChem CID | 55432 |
|---|
| ChEBI | CHEBI:82493 |
|---|
| DTXSID | DTXSID20235190 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
|---|
| Polarare Oberfläche (TPSA) | 52,3 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 4 |
|---|
| Frei drehbare Bindungen | 0 |
|---|
| Schwere Atome | 19 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 386 |
|---|
| Siedepunkt | 394.39°C (rough estimate) |
|---|
| Dichte | 1.2233 (rough estimate) |
|---|
| Brechungsindex | 1.6231 (estimate) |
|---|
Sicherheit & Vorschriften
| Carcinogen Classification | 7-Methylpyrido[3,4-c]psoralenGroup 3: Not classifiable as to its carcinogenicity to humansVolume 40: (1986) Some Naturally Occurring and Synthetic Food Components, Furocoumarins and Ultraviolet Radiation1987 |
|---|
