HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
α-Methylphenethylacetat
α-methylphenethylacetate · 2-ACETOXY-1-PHENYLPROPANE · 1-phenyl-2-propanolacetate · methylbenzylcarbinylacetate · benzylmethylcarbinylacetate · alpha-Methylphenethylacetat · 1-phenylpropan-2-yl acetate · alpha-methylphenethylacetate
Identifikatoren & physikalische Daten
| CAS No. | 2114-33-2 |
|---|---|
| Summenformel | C11H14O2 |
| Durchschnittliche Molmasse | 178,23 g/mol |
| Monoisotopische Masse | 178,09937969 g/mol |
| SMILES | CC(=O)OC(C)Cc1ccccc1 |
| InChIKey | LOHDWLZDQXQLJA-UHFFFAOYSA-N |
| PubChem CID | 16457 |
| EC No. | 218-314-3 |
| DTXSID | DTXSID30862835 |
| Lokaler Name | α-Methylphenethylacetat |
Chemische & physikalische Eigenschaften
| XLogP | 2,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 159 |
| Siedepunkt | 270.46°C (rough estimate) |
| Dichte | 1.0292 (rough estimate) |
| Brechungsindex | 1.5090 (estimate) |
| Löslichkeit | Almost insoluble in water, soluble in alcohol and oils. |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Almost colorless |
| Geruch | Fresh-floral, slightly green and fruity odor with a Hyacinth-like note |
| Kosmetik-Inhaltsstoffe Funktionen | PERFUMING |
| LogP (Verteilungskoeffizient) | 2.652 (est) |
| EPA chemische Informationen | Benzeneethanol, .alpha.-methyl-, acetate (2114-33-2) |
Sicherheit & Vorschriften
| Regulatorische Informationen | Chemical: Benzeneethanol, .alpha.-methyl-, acetateBenzeneethanol, .alpha.-methyl-, acetate: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
|---|---|
| Weitere Sicherheitsinformationen | IMAP assessments - Benzeneethanol, .alpha.-methyl-, acetate: Human health tier I assessmentIMAP assessments - Benzeneethanol, .alpha.-methyl-, acetate: Environment tier I assessment |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2916399090 |
| RTECS-Nr. | AI9316000 |
| Toxizität | skn-rbt 500 mg/24H MLD FCTOD7 20,737,82 |
Anwendungen & Verwendung
Verwenden
1-Methyl-2-phenylethyl Acetate could be used as a modifier in many floral or Oriental fragrance types, in Fougeres, etc. It is stable in soap and it is actually extremely versatile in its use, from distinctly floral to strictly herbaceous or green.