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4-Morpholinoanilin
N-(4-AMINOPHENYL)MORPHOLINE · Clemastine Impurity 6 · AKOS B025582 · AKOS BB-8569 · ASISCHEM Z37706 · AKOS BBS-00006991 · 4-MORPHOLINOANILINE · ART-CHEM-BB B025582
Identifikatoren & physikalische Daten
| CAS No. | 2524-67-6 |
|---|---|
| Summenformel | C10H14N2O |
| Durchschnittliche Molmasse | 178,23 g/mol |
| Monoisotopische Masse | 178,11061307 g/mol |
| SMILES | Nc1ccc(N2CCOCC2)cc1 |
| InChIKey | PHNDZBFLOPIMSM-UHFFFAOYSA-N |
| PubChem CID | 75655 |
| EC No. | 219-760-1 |
| DTXSID | DTXSID8062490 |
| Lokaler Name | 4-Morpholinoanilin |
Chemische & physikalische Eigenschaften
| XLogP | 0,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 38,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 149 |
| Schmelzpunkt | 132-135 °C(lit.) |
| Siedepunkt | 310.47°C (rough estimate) |
| Dichte | 1.0777 (rough estimate) |
| Brechungsindex | 1.5250 (estimate) |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
| Löslichkeit | Soluble in chloroform, ethyl acetate. |
| pKa (Säurekonstante) | 6.72±0.40(Predicted) |
| Aggregatzustand | Crystalline Powder |
| Farbe | Purple to brown |
| BRN | 150957 |
| InChI | InChI=1S/C10H14N2O/c11-9-1-3-10(4-2-9)12-5-7-13-8-6-12/h1-4H,5-8,11H2 |
| InChIKey | PHNDZBFLOPIMSM-UHFFFAOYSA-N |
| SMILES | C1(N)=CC=C(N2CCOCC2)C=C1 |
| CAS Datenbank | 2524-67-6(CAS DataBase Reference) |
| EPA chemische Informationen | 4-(4-Morpholino)aniline (2524-67-6) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (18.5%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 54 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (18.5%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN2811 |
| Zollcode | 29349990 |
| R-Sätze (R) | 36/37/38-20/21/22 |
| Gefahrensymbole | Xi,Xn |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-37/39-36/37/39-22 |
| Gefahrenklasse | 6.1Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
4-Morpholinoaniline is a morpholine derivative used in the preparation of central nervous system (CNS) active agents. 4-Morpholinoaniline is also one of the primary aromatic amines used in the colour developing process in photographs.