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HCID 533787Erstellt: 26. Oktober 2026
Ethyl 3-hydroxy-2-methyl-4,4,4-trifluorobutyrate
ETHYL 2-METHYL-3-HYDROXY-4,4,4-TRIFLUOROBUTYRATE · ETHYL 3-HYDROXY-2-METHYL-4,4,4-TRIFLUOROBUTYRATE · Ethyl 4,4,4-trifluoro-3-hydroxy-2-methylbutyrate · Ethyl2-methyl-3-hydroxy-4,4,4-trifluorobutyrate95% · 2-ethyl-4,4,4-trifluoro-3-hydroxy-2-methylbutanoate · Ethyl 2-methyl-3-hydroxy-4,4,4-trifluorobutyrate 95% · 3-hydroxy-2-methyl-4,4,4-trifluorobutyric acid ethyl ester · 4,4,4-Trifluoro-3-Hydroxy-2-Methyl-Butanoic Acid Ethyl Ester
https://huagongshe.com/de/chemical/533787
Identifikatoren & physikalische Daten
| CAS No. | 649-56-9 |
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| Summenformel | C7H11F3O3 |
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| Durchschnittliche Molmasse | 200,16 g/mol |
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| Monoisotopische Masse | 200,06602887 g/mol |
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| SMILES | CCOC(=O)C(C)C(O)C(F)(F)F |
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| InChIKey | MFRIOKNLYRUYHP-UHFFFAOYSA-N |
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| PubChem CID | 533787 |
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| EC No. | 670-546-8 |
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| DTXSID | DTXSID00336437 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,5 |
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| Polarare Oberfläche (TPSA) | 46,5 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 6 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 178 |
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| Siedepunkt | 180 °C |
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| Dichte | 1.233±0.06 g/cm3(Predicted) |
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| Flammpunkt | 180-184°C |
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| pKa (Säurekonstante) | 11.73±0.20(Predicted) |
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| BRN | 6194166 |
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| CAS Datenbank | 91600-33-8(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Zollcode | 2918199890 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36 |
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| Gefahrenklasse | IRRITANT |
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