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N,N''-Di-Z-diethylenetriamine
Dibenzyl (azanediylbis(ethane-2,1-diyl))dicarbamate · Z-EDA-EDA-Z · CAS_160256-75-7 · N,N''-DI-Z-DIETHYLENETRIAMINE · N,N″-Di-Z-diethylenetriamine · DIBENZYL 2,2'-IMINOBIS(ETHYLCARBAMATE) · N,N''-Di-Z-diethylenetriamine≥ 97% (HPLC) · N,N''-DI-BENZYLOXYCARBONYL-DIETHYLENETRIAMINE
Identifikatoren & physikalische Daten
| CAS No. | 160256-75-7 |
|---|---|
| Summenformel | C20H25N3O4 |
| Durchschnittliche Molmasse | 371,4 g/mol |
| Monoisotopische Masse | 371,18450629 g/mol |
| SMILES | O=C(NCCNCCNC(=O)OCc1ccccc1)OCc1ccccc1 |
| InChIKey | DWPBEWIGNADCAX-UHFFFAOYSA-N |
| PubChem CID | 4367374 |
| EC No. | 626-460-8 |
| DTXSID | DTXSID30402452 |
Chemische & physikalische Eigenschaften
| XLogP | 2,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 88,7 |
| H-Brücken-Donoren | 3 |
| H-Brücken-Akzeptoren | 5 |
| Frei drehbare Bindungen | 12 |
| Schwere Atome | 27 |
| Formalladung | 0 |
| Komplexität | 383 |
| Schmelzpunkt | 70-74 °C |
| Siedepunkt | 581.773±50.00 °C(Press: 760.00 Torr)(predicted) |
| Dichte | 1.178±0.06 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 12.067±0.46(predicted) |
| BRN | 7083538 |
| InChI | 1S/C20H25N3O4/c24-19(26-15-17-7-3-1-4-8-17)22-13-11-21-12-14-23-20(25)27-16-18-9-5-2-6-10-18/h1-10,21H,11-16H2,(H,22,24)(H,23,25) |
| InChIKey | DWPBEWIGNADCAX-UHFFFAOYSA-N |
| SMILES | O=C(NCCNCCNC(=O)OCc1ccccc1)OCc2ccccc2 |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye Dam. 1 (100%)STOT SE 3 (100%)Aquatic Acute 1 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 3077 9/PG 3 |
| R-Sätze (R) | 37/38-41-50 |
| Gefahrensymbole | Xi,N |
| Sicherheitshinweise (S) | 26-39-61 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Aquatic Acute 1Eye Dam. 1Skin Irrit. 2STOT SE 3 |
Anwendungen & Verwendung
Verwenden
Building block to introduce e.g. a protected 2,2'-iminodi(ethylamine) scaffold in libraries.