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2-Benzylaminoethyldimethylamin
NSC 118969 · NSC 111162 · N-Benzyl-N,N-dimethylenediamine · N'-Benzyl-n,n-dimethylethylened · 2-benzylaminoethyldimethylamine · N'-BENZYL-N,N-DIMETHYLETYLENEDIAMINE · N,N-Dimethyl-N'-benzylethylenediamine · N2-Benzyl-N,N-dimethylethylenediamine
Identifikatoren & physikalische Daten
| CAS No. | 103-55-9 |
|---|---|
| Summenformel | C11H18N2 |
| Durchschnittliche Molmasse | 178,27 g/mol |
| Monoisotopische Masse | 178,14699858 g/mol |
| SMILES | CN(C)CCNCc1ccccc1 |
| InChIKey | LLSJAFHDYCTFCM-UHFFFAOYSA-N |
| PubChem CID | 66029 |
| EC No. | 203-122-4 |
| DTXSID | DTXSID2059275 |
| Lokaler Name | 2-Benzylaminoethyldimethylamin |
Chemische & physikalische Eigenschaften
| XLogP | 1,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 15,3 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 117 |
| Siedepunkt | 122-124 °C11 mm Hg(lit.) |
| Dichte | 0.922 g/mL at 25 °C(lit.) |
| Brechungsindex | n20/D 1.509(lit.) |
| Flammpunkt | >230 °F |
| pKa (Säurekonstante) | 9.35±0.19(Predicted) |
| Aggregatzustand | liquid |
| BRN | 2641339 |
| InChI | InChI=1S/C11H18N2/c1-13(2)9-8-12-10-11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3 |
| InChIKey | LLSJAFHDYCTFCM-UHFFFAOYSA-N |
| SMILES | C(N(C)C)CNCC1=CC=CC=C1 |
| CAS Datenbank | 103-55-9(CAS DataBase Reference) |
| EPA chemische Informationen | 1,2-Ethanediamine, N,N-dimethyl-N'-(phenylmethyl)- (103-55-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (11.6%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: 1,2-Ethanediamine, N,N-dimethyl-N'-(phenylmethyl)- |
| Weitere Sicherheitsinformationen | Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia |
| Hazard Classes and Categories | Skin Corr. 1B (11.6%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN2735 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-37/39 |
| Gefahrenklasse | 8 |
| Verpackungsgruppe | III |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
N′-Benzyl-N,N-dimethylethylenediamine may be used in chemical synthesis studies.