HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
3-Chloro-4'-methoxypropiophenone
3-Chloro-1-(4-methox · -Chloro-4-methoxypropiophenone · B-CHLORO-4-METHOXYPROPIOPHENONE · 2-CHLORO-4'-METHOXYPROPIOPHENONE · 4'-Methoxy-3-chloropropiophenone · 3-Chloro-4'-methoxypropiophenone · 3-CHLORO-4'-METHOXY PROPIOPHENONE · 3'-CHLORO-4-METHOXY PROPIOPHENONE
Identifikatoren & physikalische Daten
| CAS No. | 35999-20-3 |
|---|---|
| Summenformel | C10H11ClO2 |
| Durchschnittliche Molmasse | 198,64 g/mol |
| Monoisotopische Masse | 198,04475727 g/mol |
| SMILES | COc1ccc(C(=O)CCCl)cc1 |
| InChIKey | FJBUZSAECLLZOL-UHFFFAOYSA-N |
| PubChem CID | 233255 |
| EC No. | 806-929-5 |
| DTXSID | DTXSID40283451 |
Chemische & physikalische Eigenschaften
| XLogP | 2,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 162 |
| Schmelzpunkt | 61.0 to 65.0 °C |
| Siedepunkt | 330.036±22.00 °C(Press: 760.00 Torr)(predicted) |
| Dichte | 1.149±0.06 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |
| Lagerbedingungen | Inert atmosphere,Room Temperature |
| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
| Aggregatzustand | Solid |
| Farbe | Off-White to Light Beige |
| CAS Datenbank | 35999-20-3(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Zollcode | 2914790090 |
Anwendungen & Verwendung
Verwenden
3-Chloro-1-(4-methoxyphenyl)propan-1-one can be used as potent PARP-1 inhibitors and antitumor agents.