HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 29759Erstellt: 27. Oktober 2026
2-Methyl-3-phenylbutyric acid
2-METHYL-3-PHENYLBUTYRIC ACID
https://huagongshe.com/de/chemical/29759
Identifikatoren & physikalische Daten
| CAS No. | 19731-91-0 |
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| Summenformel | C11H14O2 |
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| Durchschnittliche Molmasse | 178,23 g/mol |
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| Monoisotopische Masse | 178,09937969 g/mol |
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| SMILES | CC(C(=O)O)C(C)c1ccccc1 |
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| InChIKey | NRYIIIVJCVRSSH-UHFFFAOYSA-N |
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| PubChem CID | 29759 |
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| EC No. | 666-114-3 |
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| DTXSID | DTXSID30941492 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,6 |
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| Polarare Oberfläche (TPSA) | 37,3 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 171 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Skin Sens. 1 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H317 |
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