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| IUPAC Name: | 2,2,4-trimethyl-1H-quinoline |
| Description: | Stability: Light SensitiveApplications: 1,2-Dihydro-2,2,4-trimethylquinoline is used as an antioxidant in styrene-butadiene and nitrile-butadiene rubbers and latexes. It was selected for evaluation because it is a derivative of quinoline, a known rodent carcinogen, and was regarded as having potential carcinogenic activity. |
| Molecular Weight: | 173.25 |
| Molecular Formula: | C12H15N |
| Canonical SMILES: | CC1=CC(NC2=CC=CC=C12)(C)C |
| InChI: | InChI=1S/C12H15N/c1-9-8-12(2,3)13-11-7-5-4-6-10(9)11/h4-8,13H,1-3H3 |
| InChI Key: | ZNRLMGFXSPUZNR-UHFFFAOYSA-N |
| Boiling Point: | 293.92 °C (rough estimate) |
| Melting Point: | 120 °C |
| Flash Point: | 214 °F |
| Density: | 1.0215 (rou gh estimate) |
| Solubility: | less than 0.1 mg/mL at 66 °F |
| Appearance: | Dark yellow to very dark brown oil |
| Storage: | Amber Vial, Refrigerator, Under inert atmosphere |
| Decomposition: | Disaster hazard: see quinoline. Dangerous; when heated to decomposition it emits toxic fumes of /nitrogen oxides /quinoline |
| LogP: | 3.43200 |
| Refractive Index: | 1.5680 (estimate) |
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Quinoline/Isoquinoline
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