HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
6-Ethylchrysen
Chrysene, 6-ethyl- · 6-Ethylchrysene in toluene
Identifikatoren & physikalische Daten
| CAS No. | 2732-58-3 |
|---|---|
| Summenformel | C20H16 |
| Durchschnittliche Molmasse | 256,3 g/mol |
| Monoisotopische Masse | 256,12520051 g/mol |
| SMILES | CCc1cc2c3ccccc3ccc2c2ccccc12 |
| InChIKey | ZJSYTTGSPQNXKT-UHFFFAOYSA-N |
| PubChem CID | 75951 |
| EC No. | 220-349-4 |
| DTXSID | DTXSID00181767 |
| Lokaler Name | 6-Ethylchrysen |
Chemische & physikalische Eigenschaften
| XLogP | 6,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 0 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 20 |
| Formalladung | 0 |
| Komplexität | 333 |
| Schmelzpunkt | 126.4-126.8 °C |
| Siedepunkt | 457.2±12.0 °C(Predicted) |
| Dichte | 1.141±0.06 g/cm3(Predicted) |
| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
| Aggregatzustand | Solid |
| Farbe | White to Off-White |
| Henry-Konstante | 1.8×100 mol/(m3Pa) at 25℃, Parnis et al. (2015) |
Anwendungen & Verwendung
Verwenden
6-Ethylchrysene is a persistent organic pollutant (POP). It is a derivative of chrysene (C428000) which is considered as a carcinogen.