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Methylisobutyrat
PURASORB(R) PL · Resomer L 209S · LACTEL BP-0600 · PURASORB(R) PL8 · PURASORB(R) PL6 · PURASORB(R) PL4 · PURASORB(R) PL2 · PURASORB(R) PL10
Identifikatoren & physikalische Daten
| CAS No. | 26161-42-2 |
|---|---|
| Summenformel | C5H10O2 |
| Durchschnittliche Molmasse | 102,13 g/mol |
| Monoisotopische Masse | 102,06807956 g/mol |
| SMILES | COC(=O)C(C)C |
| InChIKey | BHIWKHZACMWKOJ-UHFFFAOYSA-N |
| PubChem CID | 11039 |
| ChEBI | CHEBI:73689 |
| EC No. | 208-929-5 |
| DTXSID | DTXSID5060275 |
Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 7 |
| Formalladung | 0 |
| Komplexität | 66,5 |
| SpringerMaterials Properties | Boiling point |
| Duftstoffe | Fragrance Ingredient (Methyl isobutyrate) -> IFRA transparency List |
| Lebensmittelzusatzstoffe | FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food |
| Dichte | 0.884-0.8881.290 g/cm3 |
| Aromastoffe | EU Flavoring substances |
| Löslichkeit | 1 ml in 1 ml 95% alcohol (in ethanol) |
| Siedepunkt | 91.00 to 93.00 °C. @ 760.00 mm Hg90 °C |
| Schmelzpunkt | -84.7 °C220℃ |
| Brechungsindex | 1.382-1.386 |
| Physical Description | Liquidcolourless liquid |
| Lagerbedingungen | -20°C |
| Aggregatzustand | pellets |
| Farbe | faint beige to beige |
| Hauptanwendungen | cell analysis |
| InChI | 1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m1/s1 |
| InChIKey | JVTAAEKCZFNVCJ-UWTATZPHSA-N |
| SMILES | C[C@@H](O)C(O)=O |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH225 (> 99.9%): Highly Flammable liquid and vapor [Danger 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 1750 reports by companies from 4 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: Propanoic acid, 2-methyl-, methyl esterStatus: Active Update: 06-04-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/25782Methyl isobutyrate: Does not have an individual approval but may be used under an appropriate group standard |
| Weitere Sicherheitsinformationen | IMAP assessments - Propanoic acid, 2-methyl-, methyl ester: Human health tier I assessment |
| Hazard Classes and Categories | Flam. Liq. 2 (> 99.9%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Sicherheitshinweise (S) | 22-24/25 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
Medical device