W342106

4-Oxoisophoron

≥98%, FG

• Synonym(e): 2,6,6-Trimethyl-2-cyclohexen-1,4-dion, 4-Oxoisophoron, Ketoisophoron
• Empirische Formel (Hill-System): C₉H₁₂O₂
• CAS-Nummer: 1125-21-9
• Molekulargewicht: 152.19
• FEMA-Nummer: 3421
• Beilstein: 2207030
• EG-Nummer: 214-406-2
• CoE-Nummer: 11200
• MDL-Nummer: MFCD00043119
• UNSPSC-Code: 12164502
• PubChem Substanz-ID: 24901693
• Flavis-Nummer: 7.109
• NACRES: NA.21

Eigenschaften

• Biologische Quelle: synthetic
• Qualitätsniveau: 400
• Qualität: FG; Fragrance grade; Halal; Kosher
• Agentur: follows IFRA guidelines; meets purity specifications of JECFA
• Einhaltung gesetzlicher Vorschriften: EU Regulation 1223/2009; EU Regulation 1334/2008 & 178/2002
• Assay: ≥98%
• Brechungsindex: n20/D 1.491 (lit.)
• bp: 222 °C (lit.); 92-94 °C/11 mmHg (lit.)
• mp (Schmelzpunkt): 26-28 °C (lit.)
• Anwendung(en): flavors and fragrances
• Dokumentation: see Safety & Documentation for available documents
• Nahrungsmittelallergen: no known allergens
• Allergener Duftstoff: no known allergens
• Organoleptisch: musty; woody; sweet
• SMILES String: CC1=CC(=O)CC(C)(C)C1=O
• InChI: 1S/C9H12O2/c1-6-4-7(10)5-9(2,3)8(6)11/h4H,5H2,1-3H3
• InChIKey: AYJXHIDNNLJQDT-UHFFFAOYSA-N

Beschreibung

Allgemeine Beschreibung

4-Oxoisophorone ist eine Geschmacksverbindung, die in Tabak und Saffran vorkommt.

Anwendung

<ul>
<li><strong>Characterization of Evodia rutaecarpa (Juss) Benth honey: volatile profile, odor-active compounds and odor properties.</strong> This study investigates the unique aroma compounds in Evodia rutaecarpa honey, identifying 4-Oxoisophorone as a key component influencing its sensory characteristics, crucial for developing enhanced food products with distinct flavors (Li et al., 2024).</li>
<li><strong>Enantioselective Total Synthesis of (R,R)-Blumenol B and d(9)-(R,R)-Blumenol B.</strong> Describes the synthesis of biologically active compounds using 4-Oxoisophorone as a precursor, demonstrating its versatility in chemical synthesis and potential applications in developing pharmaceutical agents (Tan et al., 2022).</li>
<li><strong>The mystery of the butterfly bush Buddleja davidii: How are the butterflies attracted </strong> Explores the chemical attractants of Buddleja davidii, with 4-Oxoisophorone identified as a significant attractant, which could have implications for enhancing biodiversity and garden ecology (Lehner et al., 2022).</li>
</ul>

Sicherheitshinweise

• Piktogramme: GHS07
• Signalwort: Warning
• H-Sätze: H317
• P-Sätze: P280 - P302 + P352
• Gefahreneinstufungen: Skin Sens. 1
• Lagerklassenschlüssel: 11 - Combustible Solids
• WGK: WGK 1
• Persönliche Schutzausrüstung: dust mask type N95 (US), Eyeshields, Faceshields, Gloves