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HCID 11676Erstellt: 27. Oktober 2026
2,3,3-Trimethyl-2-butanol
2,3,3-trimethylbutan-2-ol · 2-Butanol, 2,3,3-trimethyl- · pentamethylethanol · 2-tert-Butyl-2-propanol · 2,3,3-Trimethyl-2-butanol · 2,2,3-TRI METHYL-2-BUTANOL · 1,1,2,2-Tetramethyl-1-propanol
https://huagongshe.com/de/chemical/11676
Identifikatoren & physikalische Daten
| CAS No. | 594-83-2 |
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| Summenformel | C7H16O |
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| Durchschnittliche Molmasse | 116,2 g/mol |
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| Monoisotopische Masse | 116,12011513 g/mol |
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| SMILES | CC(C)(C)C(C)(C)O |
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| InChIKey | OKXVARYIKDXAEO-UHFFFAOYSA-N |
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| PubChem CID | 11676 |
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| EC No. | 841-330-2 |
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| DTXSID | DTXSID40208129 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,9 |
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| Polarare Oberfläche (TPSA) | 20,2 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 8 |
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| Formalladung | 0 |
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| Komplexität | 76,9 |
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| SpringerMaterials Properties | Boiling point |
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| Schmelzpunkt | 17°C |
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| Siedepunkt | 129.85°C |
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| Dichte | 0.8380 |
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| Brechungsindex | 1.4280 |
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| Lagerbedingungen | 2-8°C |
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| pKa (Säurekonstante) | 15.38±0.29(Predicted) |
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| Löslichkeit | 21.53g/L(40 ºC) |
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| Henry-Konstante | 2.7×10-1 mol/(m3Pa) at 25℃, Yaws et al. (1997) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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 | Flam. Liq. 3 (100%) |
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| Zollcode | 2905190098 |
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