HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
1-(4-Bromo-3-methylphenyl)ethanone
Fluralaner Impurity 29 · 3-Methyl-4-bromoacetophenone · NSC 405623 · Fluralaner-003 · 4-Bromo-3-methylacetophenone · 4-bromo-3-methylbenzenethylone · 4'-Bromo-3'-methylacetophenone · Ethanone, 1-(4-broMo-3-Methylphenyl)-
Identifikatoren & physikalische Daten
| CAS No. | 37074-40-1 |
|---|---|
| Summenformel | C9H9BrO |
| Durchschnittliche Molmasse | 213,07 g/mol |
| Monoisotopische Masse | 211,98367701 g/mol |
| SMILES | CC(=O)c1ccc(Br)c(C)c1 |
| InChIKey | QRTFRIPKQPOIPI-UHFFFAOYSA-N |
| PubChem CID | 347124 |
| EC No. | 864-619-5 |
| DTXSID | DTXSID70324063 |
Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 17,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 156 |
| Schmelzpunkt | 31-32 °C |
| Siedepunkt | 157-159 °C(Press: 19 Torr) |
| Dichte | 1.388±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
| Aggregatzustand | fused solid |
| Farbe | Pale lemon |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Zollcode | 2914390090 |
Anwendungen & Verwendung
Verwenden
4'-Bromo-3'-methylacetophenone is a versatile building block that is used in the synthesis of many complex compounds. It can be used as a reactant, reagent, or speciality chemical.