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N-Aminophthalimid
2-AMINOISOINDOLINE-1,3-DIONE · 2-aminoisoindoline-1,3-dione 98% · aminophthalimide · Phthalimidylamine · N-Aminopthalimide · N-Aminophthalimide · Aminophthalimidetech · SPECS AQ-344/40414632
Identifikatoren & physikalische Daten
| CAS No. | 1875-48-5 |
|---|---|
| Summenformel | C8H6N2O2 |
| Durchschnittliche Molmasse | 162,15 g/mol |
| Monoisotopische Masse | 162,04292743 g/mol |
| SMILES | NN1C(=O)c2ccccc2C1=O |
| InChIKey | KSILMCDYDAKOJD-UHFFFAOYSA-N |
| PubChem CID | 74645 |
| EC No. | 217-505-9 |
| DTXSID | DTXSID70172061 |
| Lokaler Name | N-Aminophthalimid |
Chemische & physikalische Eigenschaften
| XLogP | 0,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 63,4 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 12 |
| Formalladung | 0 |
| Komplexität | 215 |
| Stoffklassen | Nitrogen Compounds -> Hydrazides |
| Physical Description | Solid[Sigma-Aldrich MSDS] |
| Schmelzpunkt | 200-202 °C(lit.) |
| Siedepunkt | 288.82°C (rough estimate) |
| Dichte | 1.3264 (rough estimate) |
| Brechungsindex | 1.5770 (estimate) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Löslichkeit | Solubility in hot methanol almost transparent. |
| pKa (Säurekonstante) | -1.73±0.20(Predicted) |
| Aggregatzustand | powder to crystal |
| Farbe | White to Light yellow |
| BRN | 383756 |
| InChI | InChI=1S/C8H6N2O2/c9-10-7(11)5-3-1-2-4-6(5)8(10)12/h1-4H,9H2 |
| InChIKey | KSILMCDYDAKOJD-UHFFFAOYSA-N |
| SMILES | C1(=O)C2=C(C=CC=C2)C(=O)N1N |
| CAS Datenbank | 1875-48-5(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P233, P260, P261, P264, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 72 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Gefahrenübersicht | A skin and strong eye irritantMay cause skin and respiratory sensitization[Sigma-Aldrich MSDS] Search for (1875-48-5[EC/RN Number]) AND (sensitizer OR sensitization OR allergic OR dermatitis): no results[PubMed] See Phthalimide. See 1,2,3,6-Tetrahydrophthalimide, Folpet, and N-(Cyclohexylthio)phthalimide. |
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| F | 9 |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29251900 |
| R-Sätze (R) | 36/37/38-42/43 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) | 22-26-36/37-45 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Eye Irrit. 2Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3 |
Anwendungen & Verwendung
Verwenden
It is employed in the aziridination of chiral N-enoyl sultams. It is also used in the synthesis of n-phthalimidoaziridines