HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-(2-(2-(6,6-Dimethylbicyclo(3.1.1)hept-2-yl)ethoxy)ethyl)morpholine
5S)-4-[2-[2-(6 · Pinaverium Impurity · Pivalomycin impurity · Pinaverium Impurity 1 · Piverium bromide impurity 9 · Pividium bromide impurity 1 · Pinaverium Bromide Impurity 9 · Pinaverium Bromide Impurity 19 (Mixture of Diastereomers)
Identifikatoren & physikalische Daten
| CAS No. | 38284-47-8 |
|---|---|
| Summenformel | C17H31NO2 |
| Durchschnittliche Molmasse | 281,4 g/mol |
| Monoisotopische Masse | 281,23547923 g/mol |
| SMILES | CC1(C)C2CCC(CCOCCN3CCOCC3)C1C2 |
| InChIKey | FPLHEALBGYMFJM-UHFFFAOYSA-N |
| PubChem CID | 3052016 |
| EC No. | 609-541-2 |
| DTXSID | DTXSID301158273 |
Chemische & physikalische Eigenschaften
| XLogP | 3,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 21,7 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 6 |
| Schwere Atome | 20 |
| Formalladung | 0 |
| Komplexität | 312 |
| Siedepunkt | 356.2±22.0 °C(Predicted) |
| Dichte | 0.986±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Refrigerator |
| Löslichkeit | Chloroform (Slightly), Ethyl Acetate (Slightly) |
| Aggregatzustand | Oil |
| pKa (Säurekonstante) | 6+-.0.10(Predicted) |
| Farbe | Yellow to Orange |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.Not ClassifiedAggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | REACH registered substance: 2-((6,6-diméthylbicyclo[3.1.1]hept-2-yl)éthoxy)éthyl morpholine (EC: 609-541-2) |
| Hazard Classes and Categories | Not Classified |
Anwendungen & Verwendung
Verwenden
(1S,2S,5S)-4-[2-[2-(6,6-Dimethylbicyclo[3.1.1]hept-2-yl)ethoxy]ethyl]morpholine, is used for the synthesis of Pinaverium Bromide (P465000), a drug used for functional gastrointestinal disorders.