HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Methyl-6-nitroquinoline
SKL649 · AKOS 92899 · AKOS BBS-00003134 · 6-NITROQUINALDINE · 6-Nitro-2-methylquinoline · 2-methyl-6-nitro-quinolin · 2-METHYL-6-NITROQUINOLINE · 2-Methyl-6-nitroquinoxaline
Identifikatoren & physikalische Daten
| CAS No. | 613-30-9 |
|---|---|
| Summenformel | C10H8N2O2 |
| Durchschnittliche Molmasse | 188,18 g/mol |
| Monoisotopische Masse | 188,0585775 g/mol |
| SMILES | Cc1ccc2cc([N+](=O)[O-])ccc2n1 |
| InChIKey | DXDPHHQJZWWAEH-UHFFFAOYSA-N |
| PubChem CID | 69172 |
| ChEMBL | CHEMBL1447249 |
| EC No. | 664-208-9 |
| DTXSID | DTXSID3060619 |
Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 58,7 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 227 |
| Löslichkeit | 20.5 [ug/mL] (The mean of the results at pH 7.4) |
| Schmelzpunkt | 165 °C |
| Siedepunkt | 334.7±22.0 °C(Predicted) |
| Dichte | 1.298±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | powder to crystal |
| pKa (Säurekonstante) | 4.08±0.43(Predicted) |
| Farbe | White to Light yellow to Light orange |
| BRN | 7915 |
| CAS Datenbank | 613-30-9(CAS DataBase Reference) |
| EPA chemische Informationen | Quinoline, 2-methyl-6-nitro- (613-30-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (88.6%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H318 (86.4%): Causes serious eye damage [Danger Serious eye damage/eye irritation]H319 (13.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, 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 44 reports by companies from 4 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. |
|---|---|
| Regulatorische Informationen | PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance. |
| Hazard Classes and Categories | Acute Tox. 4 (88.6%)Skin Irrit. 2 (100%)Eye Dam. 1 (86.4%)Eye Irrit. 2A (13.6%)STOT SE 3 (97.7%) |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2933499090 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-36/37/39 |
Anwendungen & Verwendung
Verwenden
2-Methyl-6-nitroquinoline is a reagent that is used as a potent, selective, and orally efficacious antagonists of melanin-concentrating hormone receptor 1.