HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 97883Erstellt: 3. November 2026
2-Methylbutylisobutyrat
Isoamyl isobutyrate · Propanoic acid, 2-methyl-, 2-methylbutyl ester · 2-Methylbutyl isobutyrate · 2-Methylbutyl 2-methylpropionate · Methyl-2-butyl-iso-butyrate · 2-methylbutyl 2-methylpropanoate · Methyl-2-butyl-isobutyrate >=99.0% · Isobutyric acid, 2-methylbutyl ester
https://huagongshe.com/de/chemical/97883
Identifikatoren & physikalische Daten
| CAS No. | 2445-69-4 |
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| Summenformel | C9H18O2 |
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| Durchschnittliche Molmasse | 158,24 g/mol |
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| Monoisotopische Masse | 158,13067981 g/mol |
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| SMILES | CCC(C)COC(=O)C(C)C |
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| InChIKey | DUAXUBMIVRZGCO-UHFFFAOYSA-N |
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| PubChem CID | 97883 |
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| ChEBI | CHEBI:167088 |
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| EC No. | 219-493-0 |
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| DTXSID | DTXSID80862946 |
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| Lokaler Name | 2-Methylbutylisobutyrat |
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Chemische & physikalische Eigenschaften
| XLogP | 2,8 |
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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 | 11 |
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| Formalladung | 0 |
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| Komplexität | 119 |
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| Lipide | Fatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710] |
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| Aromastoffe | EU Flavoring substances |
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| Schmelzpunkt | -73°C (estimate) |
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| Siedepunkt | 183.34°C (estimate) |
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| Dichte | 0.8809 (estimate) |
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| Brechungsindex | 1.3845 (estimate) |
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| FEMA | 3507 | 3-METHYLBUTYL 2-METHYLPROPANOATE |
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| Geruch | at 100.00 %. fruity ethereal tropical banana |
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| Geruchsart | fruity |
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| LogP (Verteilungskoeffizient) | 3.021 (est) |
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| NIST chemische Informationen | Propanoic acid, 2-methyl-, 2-methylbutyl ester(2445-69-4) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. |
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| Regulatorische Informationen | Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)Propanoic acid, 2-methyl-, 2-methylbutyl ester: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazard Classes and Categories | Flam. Liq. 3 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H226 |
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