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2-Isopropenylpyridin
2-(prop-1-en-2-yl)pyridine · Einecs 229-404-7 · Axitinib Impurity 46 · 2-isopropenylpyridine · 2-(1-Propen-2-yl)pyridine · 2-(1-Methylethenyl)pyridine · Pyridine, 2-(1-Methylethenyl)-
Identifikatoren & physikalische Daten
| CAS No. | 6515-13-5 |
|---|---|
| Summenformel | C8H9N |
| Durchschnittliche Molmasse | 119,16 g/mol |
| Monoisotopische Masse | 119,07349929 g/mol |
| SMILES | C=C(C)c1ccccn1 |
| InChIKey | MJKIORXNEJFOPX-UHFFFAOYSA-N |
| PubChem CID | 81007 |
| EC No. | 229-404-7 |
| DTXSID | DTXSID20983720 |
| Lokaler Name | 2-Isopropenylpyridin |
Chemische & physikalische Eigenschaften
| XLogP | 2,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 12,9 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 107 |
| Schmelzpunkt | 170-173 °C |
| Siedepunkt | 172-176 °C |
| Dichte | 0.9706 g/cm3(Temp: 13 °C) |
| pKa (Säurekonstante) | 4.87±0.10(Predicted) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P330, P333+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 3 (100%) |