HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 136296Erstellt: 4. November 2026
1-(3-(Trifluoromethyl)phenyl)ethanol
α- Methyl-m-benzyl Alcohol · 1-[3(TRIFLUOROMETHYL)PHENYL]ETHANOL · 1-[m-(Trifluoromethyl)phenyl]ethanol · -Methyl-3-trifluoromethylbenzylalcohol · A-METHYL-3-TRIFLUOROMETHYLBENZYL ALCOHOL · Methyl 3-trifluoromethyl phenyl carbinol · 1-[3-(Trifluoromethyl)phenyl]ethanol,98% · α-Methyl-3-(trifluoromethyl)benzylalcohol
https://huagongshe.com/de/chemical/136296
Identifikatoren & physikalische Daten
| CAS No. | 454-91-1 |
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| Summenformel | C9H9F3O |
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| Durchschnittliche Molmasse | 190,16 g/mol |
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| Monoisotopische Masse | 190,06054957 g/mol |
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| SMILES | CC(O)c1cccc(C(F)(F)F)c1 |
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| InChIKey | YNVXCOKNHXMBQC-UHFFFAOYSA-N |
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| PubChem CID | 136296 |
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| EC No. | 642-813-9 |
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| DTXSID | DTXSID80963381 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,3 |
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| Polarare Oberfläche (TPSA) | 20,2 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 167 |
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| Siedepunkt | 100-102 °C17 mm Hg(lit.) |
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| Dichte | 1.249 g/mL at 25 °C(lit.) |
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| Brechungsindex | n20/D 1.458(lit.) |
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| Flammpunkt | 205 °F |
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| Lagerbedingungen | 2-8°C |
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| pKa (Säurekonstante) | 14.24±0.20(Predicted) |
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| Aggregatzustand | Liquid |
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| Wichte | 1.249 |
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| Farbe | Clear colorless to slightly yellow |
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| CAS Datenbank | 454-91-1(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)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 Irrit. 2 (100%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| Zollcode | 29062990 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi,F |
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| hazard_note | Irritant |
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| Sicherheitshinweise (S) | 24/25-37/39-26 |
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| Gefahrenklasse | FLAMMABLE |
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