HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 92543Erstellt: 27. Oktober 2026
3-Methyl-4-phenylbutan-2-ol
Ai3-24792 · muguet butanol · Einecs 260-398-9 · 3-Methyl-4-phenyl-2-butanol · 3-methyl-4-phenylbutan-2-ol · 3-Methyl-4-phenylbutane-2-ol · Benzenepropanol, α,β-dimethyl- · α,β-Dimethylbenzene-1-propanol
https://huagongshe.com/de/chemical/92543
Identifikatoren & physikalische Daten
| CAS No. | 56836-93-2 |
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| Summenformel | C11H16O |
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| Durchschnittliche Molmasse | 164,24 g/mol |
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| Monoisotopische Masse | 164,12011513 g/mol |
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| SMILES | CC(O)C(C)Cc1ccccc1 |
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| InChIKey | VSIXJPFQJMODCS-UHFFFAOYSA-N |
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| PubChem CID | 92543 |
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| EC No. | 260-398-9 |
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| DTXSID | DTXSID8052229 |
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| Lokaler Name | 3-Methyl-4-phenylbutan-2-ol |
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Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
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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 | 3 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 116 |
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| Duftstoffe | Fragrance Ingredient (Benzenepropanol, a,-dimethyl-) -> IFRA transparency List |
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| Siedepunkt | 245.5℃[at 101 325 Pa] |
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| Dichte | 0.972[at 20℃] |
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| Dampfdruck | 1.1Pa at 24℃ |
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| pKa (Säurekonstante) | 15.10±0.20(Predicted) |
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| Geruch | at 100.00 %. floral muguet green rose mentholic |
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| Geruchsart | floral |
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| Löslichkeit | 3.3g/L at 24℃ |
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| LogP (Verteilungskoeffizient) | 3.1 at 25℃ |
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| EPA chemische Informationen | Benzenepropanol, .alpha.,.beta.-dimethyl- (56836-93-2) |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 86.6% (103 of 119) of all reports.WarningH319 (13.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)Aggregated GHS information provided per 119 reports by companies from 3 notifications to the ECHA C&L Inventory. |
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| Regulatorische Informationen | Chemical: Benzenepropanol, .alpha.,.beta.-dimethyl-REACH registered substance: 3-methyl-4-phenylbutan-2-ol (EC: 260-398-9) |
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| Weitere Sicherheitsinformationen | Evaluation - Chemicals that are unlikely to require further regulation to manage risks to environment |
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| Hazard Classes and Categories | Eye Irrit. 2 (13.4%) |
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| TSCA-Inventar-Status | TSCA listed |
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