HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 246708Erstellt: 30. Oktober 2026
DL-Benzoin benzoate
benzoic acid [2-keto-1,2-di(phenyl)ethyl] ester · Desyl benzoate · DL-BENZOIN BENZOATE · 2-Oxo-1,2-diphenylethyl benzoate · Ethanone, 2-(benzoyloxy)-1,2-diphenyl- · alpha-Benzoyloxy-alpha-phenylacetophenone
https://huagongshe.com/de/chemical/246708
Identifikatoren & physikalische Daten
| CAS No. | 1459-20-7 |
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| Summenformel | C21H16O3 |
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| Durchschnittliche Molmasse | 316,3 g/mol |
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| SMILES | O=C(OC(C(=O)c1ccccc1)c1ccccc1)c1ccccc1 |
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| InChIKey | FGOSBCXOMBLILW-UHFFFAOYSA-N |
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| PubChem CID | 246708 |
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| ChEMBL | CHEMBL3601172 |
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| EC No. | 667-504-6 |
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Chemische & physikalische Eigenschaften
| XLogP | 4,9 |
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| Polarare Oberfläche (TPSA) | 43,4 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 6 |
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| Schwere Atome | 24 |
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| Formalladung | 0 |
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| Komplexität | 413 |
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| Schmelzpunkt | 123-124 °C |
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| Siedepunkt | 499.0±33.0 °C(Predicted) |
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| Dichte | 1.195±0.06 g/cm3(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
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