HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
tert-Butyl 2-(hydroxymethyl)morpholine-4-carboxylate
TERT-BUTYL 2-(HYDROXYMETHYL)MORPHOLINE-4-CARBOXYLATE · 2-Hydroxymethyl-morpholine-4-carboxylic acid tert-butyl ester · Viloxazine Impurity 3 · Boc-2-hydroxymethyl-morpholine · 4-Boc-2-hydroxymethyl-morpholine · 2-HYDROXYMETHYL-4-BOC-MORPHOLINE · N-BOC-2-(HYDROXYMETHYL)MORPHOLINE · 4-N-BOC-2-HYDROXYMETHYLMORPHOLINE
Identifikatoren & physikalische Daten
| CAS No. | 135065-69-9 |
|---|---|
| Summenformel | C10H19NO4 |
| Durchschnittliche Molmasse | 217,26 g/mol |
| Monoisotopische Masse | 217,13140809 g/mol |
| SMILES | CC(C)(C)OC(=O)N1CCOC(CO)C1 |
| InChIKey | FJYBLMJHXRWDAQ-UHFFFAOYSA-N |
| PubChem CID | 5201202 |
| ChEMBL | CHEMBL4586987 |
| EC No. | 842-996-7 |
| DTXSID | DTXSID90409523 |
Chemische & physikalische Eigenschaften
| XLogP | 0,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 59 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 15 |
| Formalladung | 0 |
| Komplexität | 224 |
| Siedepunkt | 320.7±27.0 °C(Predicted) |
| Dichte | 1.118±0.06 g/cm3(Predicted) |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | Dichloromethane, Ether, Ethyl Acetate, |
| Aggregatzustand | Oil |
| pKa (Säurekonstante) | 14.36±0.10(Predicted) |
| Farbe | Colourless |
| CAS Datenbank | 135065-69-9(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract 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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%) |
| Zollcode | 2934999090 |
| Gefahrenklasse | IRRITANT |
Anwendungen & Verwendung
Verwenden
Intermediate in the preparation of racemic analogs of Viloxazine.