Identifikatoren & physikalische Daten
| CAS No. | 444663-80-3 |
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| Summenformel | C9H7Br3O2 |
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| Durchschnittliche Molmasse | 386,86 g/mol |
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| SMILES | COC(=O)c1cc(Br)c(CBr)c(Br)c1 |
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| InChIKey | CHYJSLZNYDHTHE-UHFFFAOYSA-N |
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| PubChem CID | 22647948 |
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| EC No. | 185-950-5 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,7 |
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| Polarare Oberfläche (TPSA) | 26,3 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 198 |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, 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 | Skin Corr. 1B (100%) |
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