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HCID 98689Erstellt: 27. Oktober 2026
1-[3-(Phenylmethoxy)phenyl]ethan-1-on
NSC 159118 · m-benzyloxyacetophenone · 3-BENZYLOXYACETOPHENONE · Terbutaline Impurity 25 · Terbutaline Impurity 57 · Paracetamol Impurity 25 · 3'-Benzyloxyacetophenone · 3-Benzyloxyacetophenone,97%
https://huagongshe.com/de/chemical/98689
Identifikatoren & physikalische Daten
| CAS No. | 34068-01-4 |
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| Summenformel | C15H14O2 |
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| Durchschnittliche Molmasse | 226,27 g/mol |
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| Monoisotopische Masse | 226,09937969 g/mol |
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| SMILES | CC(=O)c1cccc(OCc2ccccc2)c1 |
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| InChIKey | FGQMEAWGAUALJQ-UHFFFAOYSA-N |
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| PubChem CID | 98689 |
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| ChEMBL | CHEMBL3770608 |
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| EC No. | 251-816-0 |
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| DTXSID | DTXSID40187667 |
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| Lokaler Name | 1-[3-(Phenylmethoxy)phenyl]ethan-1-on |
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Chemische & physikalische Eigenschaften
| XLogP | 3,5 |
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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 | 4 |
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| Schwere Atome | 17 |
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| Formalladung | 0 |
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| Komplexität | 243 |
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| Schmelzpunkt | 29-30 °C |
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| Siedepunkt | 154°C/0.3mmHg(lit.) |
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| Dichte | 1.0891 (rough estimate) |
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| Brechungsindex | 1.6530 (estimate) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| Löslichkeit | Chloroform (Sparingly), Methanol (Slightly) |
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| Aggregatzustand | Low Melting Solid |
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| Farbe | Light yellow |
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| CAS Datenbank | 34068-01-4(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, 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. |
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| Hazard Classes and Categories | Aquatic Acute 1 (100%) |
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| Zollcode | 29145000 |
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| Sicherheitshinweise (S) | 24/25 |
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![Molekülstruktur von 1-[3-(Phenylmethoxy)phenyl]ethan-1-on](/img/chemical/98689.png)