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N,N-Diethyl-2-hydroxybenzamid
2-Hydroxy-N,N-diethylbenzamide · Ai3-33468 · Brn 2835473 · Einecs 242-955-8 · Diethylsalicylamide · Salicyldiethylamide · n,n-diethyl-salicylamid · N,N-Diethylsalicylamide
Identifikatoren & physikalische Daten
| CAS No. | 19311-91-2 |
|---|---|
| Summenformel | C11H15NO2 |
| Durchschnittliche Molmasse | 193,24 g/mol |
| Monoisotopische Masse | 193,11027872 g/mol |
| SMILES | CCN(CC)C(=O)c1ccccc1O |
| InChIKey | ZVYXEXAXXWINEH-UHFFFAOYSA-N |
| PubChem CID | 88006 |
| EC No. | 242-955-8 |
| DTXSID | DTXSID20172915 |
| Lokaler Name | N,N-Diethyl-2-hydroxybenzamid |
Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 40,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 190 |
| Schmelzpunkt | 93-97 °C (lit.) |
| Siedepunkt | 340℃ |
| Dichte | 1.096 |
| Brechungsindex | 1.5080 (estimate) |
| Flammpunkt | 159℃ |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 8.73±0.30(Predicted) |
| Aggregatzustand | Crystalline Powder |
| Farbe | White to tan |
| InChI | InChI=1S/C11H15NO2/c1-3-12(4-2)11(14)9-7-5-6-8-10(9)13/h5-8,13H,3-4H2,1-2H3 |
| InChIKey | ZVYXEXAXXWINEH-UHFFFAOYSA-N |
| SMILES | C(N(CC)CC)(=O)C1=CC=CC=C1O |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 2924297099 |
| RTECS-Nr. | VN7320000 |
| R-Sätze (R) | 22-36/37/38 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) | 26-36 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Acute Tox. 4 Oral |
Anwendungen & Verwendung
Verwenden
N,N-Diethylsalicylamide is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff fields.