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HCID 577294Erstellt: 3. November 2026
4-[(2,4-Dimethylphenyl)methyl]-2,5-dimethylpyridine
4-(2,4-DIMETHYL-BENZYL)-2,5-DIMETHYL-PYRIDINE · Pyridine, 4-[(2,4-dimethylphenyl)methyl]-2,5-dimethyl-
https://huagongshe.com/de/chemical/577294
Identifikatoren & physikalische Daten
| CAS No. | 61171-07-1 |
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| Summenformel | C16H19N |
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| Durchschnittliche Molmasse | 225,33 g/mol |
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| Monoisotopische Masse | 225,15174961 g/mol |
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| SMILES | Cc1ccc(Cc2cc(C)ncc2C)c(C)c1 |
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| InChIKey | UXLQVMDEZHZLBO-UHFFFAOYSA-N |
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| PubChem CID | 577294 |
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| ChEMBL | CHEMBL1928089 |
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| EC No. | 157-497-3 |
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| DTXSID | DTXSID10341956 |
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Chemische & physikalische Eigenschaften
| XLogP | 4,3 |
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| Polarare Oberfläche (TPSA) | 12,9 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 17 |
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| Formalladung | 0 |
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| Komplexität | 238 |
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| Schmelzpunkt | 82.5-83.5 °C(Solv: hexane (110-54-3)) |
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| Siedepunkt | 349.4±11.0 °C(Predicted) |
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| Dichte | 0.991±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 6.78±0.18(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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![Molekülstruktur von 4-[(2,4-Dimethylphenyl)methyl]-2,5-dimethylpyridine](/img/chemical/577294.png)