HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Benzylnonan-1-oat
BENZYL NONANOATE · Einecs 229-316-9 · benzyl nonan-1-oate · Nonanoic acid benzyl ester · Pelargonic acid benzyl ester · Nonanoic acid, phenylmethyl ester
Identifikatoren & physikalische Daten
| CAS No. | 6471-66-5 |
|---|---|
| Summenformel | C16H24O2 |
| Durchschnittliche Molmasse | 248,36 g/mol |
| Monoisotopische Masse | 248,17763 g/mol |
| SMILES | CCCCCCCCC(=O)OCc1ccccc1 |
| InChIKey | KVIQEJMWUXBBQJ-UHFFFAOYSA-N |
| PubChem CID | 80960 |
| EC No. | 229-316-9 |
| DTXSID | DTXSID20215058 |
| Lokaler Name | Benzylnonan-1-oat |
Chemische & physikalische Eigenschaften
| XLogP | 5,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 10 |
| Schwere Atome | 18 |
| Formalladung | 0 |
| Komplexität | 207 |
| Lebensmittelzusatzstoffe | FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food |
| Dichte | 0.953-0.959 (20 °C) |
| Löslichkeit | Practically insoluble or insoluble in waterSoluble (in ethanol) |
| Siedepunkt | 126-127 °C (< 1 mm Hg) |
| Brechungsindex | 1.481-1.487 |
| Physical Description | Colourless liquidSweet, floral aroma |
| FEMA | 4626 | BENZYL NONANOATE |
| Geruch | Faint, but fresh-balsamic, slightly fatty odor. |
| Geruchsart | floral |
| JECFA Number | 2066 |
| LogP (Verteilungskoeffizient) | 5.65 |
Sicherheit & Vorschriften
| Alarmwort | Warnung |
|---|---|
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
Anwendungen & Verwendung
Verwenden
Although mainly suitable as a solvent of low odor level, Benzyl nonanoate could be used as a blender: modifier in Oriental fragrance types, in Citrus fragrances (where it could act partly as a fixative) and in Fougeres, etc. However, it does not seem to have gained much popularity among creative perfumers.