HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 250101Erstellt: 27. Oktober 2026
4-(3-Methylbutoxy)benzaldehyde
4-(Isopentyloxy)benzaldehyde · Benzaldehyde, 4-(3-methylbutoxy)-
https://huagongshe.com/de/chemical/250101
Identifikatoren & physikalische Daten
| CAS No. | 18986-09-9 |
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| Summenformel | C12H16O2 |
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| Durchschnittliche Molmasse | 192,25 g/mol |
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| Monoisotopische Masse | 192,11502975 g/mol |
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| SMILES | CC(C)CCOc1ccc(C=O)cc1 |
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| InChIKey | WWBHAIFPHGGVCW-UHFFFAOYSA-N |
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| PubChem CID | 250101 |
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| EC No. | 113-509-9 |
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| DTXSID | DTXSID20290522 |
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Chemische & physikalische Eigenschaften
| XLogP | 3 |
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| Polarare Oberfläche (TPSA) | 26,3 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 158 |
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| Siedepunkt | 136-137 °C(Press: 5 Torr) |
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| Dichte | 1.003±0.06 g/cm3(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 | Acute Tox. 4 (100%) |
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| Zollcode | 2912490090 |
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