HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Chloro-N-(2-(3,4-dimethoxy-phenyl)-ethyl)-acetamide
AKOS 221-06 · N-Chloroacetyl-3,4-dimethoxyphenethylamine · 2-CHLORO-N-(3,4-DIMETHOXYPHENETHYL)ACETAMIDE · ACETAMIDE, 2-CHLORO-N-(3,4-DIMETHOXYPHENETHYL)- · 2-Chloro-N-(2-(3,4-dimethoxyphenyl)ethyl)acetamide · 2-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide · ACETAMIDE, 2-CHLORO-N-[2-(3,4-DIMETHOXYPHENYL)ETHYL]-
Identifikatoren & physikalische Daten
| CAS No. | 14301-31-6 |
|---|---|
| Summenformel | C12H16ClNO3 |
| Durchschnittliche Molmasse | 257,71 g/mol |
| Monoisotopische Masse | 257,08187105 g/mol |
| SMILES | COc1ccc(CCNC(=O)CCl)cc1OC |
| InChIKey | WWBJEBQJHYKQHM-UHFFFAOYSA-N |
| PubChem CID | 26622 |
| EC No. | 651-694-2 |
| DTXSID | DTXSID10162289 |
Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 47,6 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 6 |
| Schwere Atome | 17 |
| Formalladung | 0 |
| Komplexität | 238 |
| Schmelzpunkt | 96 °C |
| Siedepunkt | 437.3±45.0 °C(Predicted) |
| Dichte | 1.168±0.06 g/cm3(Predicted) |
| Lagerbedingungen | 2-8°C |
| pKa (Säurekonstante) | 13.94±0.46(Predicted) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Alarmwort | Warnung |
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
Anwendungen & Verwendung
Verwenden
N-Chloroacetyl-3,4-dimethoxyphenethylamine exhibits anti-proliferative properties making it effective in the treatment of cancer.