Identifikatoren & physikalische Daten
| CAS No. | 83961-13-1 |
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| Summenformel | C5H7Br |
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| Durchschnittliche Molmasse | 147,01 g/mol |
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| Monoisotopische Masse | 145,97311 g/mol |
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| SMILES | C#CCC(C)Br |
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| InChIKey | UAJKNRZBWKPSJO-UHFFFAOYSA-N |
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| PubChem CID | 12820050 |
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| EC No. | 894-911-8 |
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Chemische & physikalische Eigenschaften
| XLogP | 2 |
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| Polarare Oberfläche (TPSA) | 0 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 0 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 6 |
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| Formalladung | 0 |
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| Komplexität | 67,3 |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH227 (100%): Combustible liquid [Warning Flammable liquids]P210, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P370+P378, P403, P403+P233, P405, 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 | Flam. Liq. 4 (100%) |
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