HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
5-Nitro-2-pyridylaminoethyl-2-amin
TIMTEC-BB SBB000234 · 5-nitro-2-pyridylaminoethyl-2-amine · N-(5-Nitro-2-pyridyl)ethylenediamine · 2-(2-AMINOETHYLAMINO)-5-NITROPYRIDINE · N1-(5-Nitropyrid-2-yl)ethane-1,2-diamine · 2-(2-AMINOETHYLAMINO)-5-NITROPYRIDINE 98% · N'-(5-nitropyridin-2-yl)ethane-1,2-diamine · N1-(5-Nitropyridin-2-yl)ethane-1,2-diamine
Identifikatoren & physikalische Daten
| CAS No. | 29602-39-9 |
|---|---|
| Summenformel | C7H10N4O2 |
| Durchschnittliche Molmasse | 182,18 g/mol |
| Monoisotopische Masse | 182,08037556 g/mol |
| SMILES | NCCNc1ccc([N+](=O)[O-])cn1 |
| InChIKey | ODHSPTHLPCXPTL-UHFFFAOYSA-N |
| PubChem CID | 122425 |
| EC No. | 249-721-4 |
| DTXSID | DTXSID40183785 |
| Lokaler Name | 5-Nitro-2-pyridylaminoethyl-2-amin |
Chemische & physikalische Eigenschaften
| XLogP | 0,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 96,8 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 5 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 170 |
| Schmelzpunkt | 126-128 °C(lit.) |
| Siedepunkt | 315.57°C (rough estimate) |
| Dichte | 1.3129 (rough estimate) |
| Brechungsindex | 1.6700 (estimate) |
| pKa (Säurekonstante) | 9.00±0.10(Predicted) |
| InChI | 1S/C7H10N4O2/c8-3-4-9-7-2-1-6(5-10-7)11(12)13/h1-2,5H,3-4,8H2,(H,9,10) |
| InChIKey | ODHSPTHLPCXPTL-UHFFFAOYSA-N |
| SMILES | NCCNc1ccc(cn1)[N+]([O-])=O |
| CAS Datenbank | 29602-39-9(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (90.7%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, 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. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (90.7%) |
| Wassergefährdungsklasse (WGK) | 3 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-37/39 |
| Gefahrenklasse | 8Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
2-(2-Aminoethylamino)-5-nitropyridine is used in matrix preparation for the quantification of phospholipids (PLs) by MALDI-TOFMS.