W342106

4-Oxoisophorone

≥98%, FG

• Sinônimo(s): 2,6,6-Trimethyl-2-cyclohexene-1,4-dione, 4-Oxoisophorone, Ketoisophorone
• Fórmula empírica (Notação de Hill): C₉H₁₂O₂
• Número CAS: 1125-21-9
• Peso molecular: 152.19
• Número FEMA: 3421
• Beilstein: 2207030
• Número CE: 214-406-2
• Conselho da Europa nº: 11200
• Número MDL: MFCD00043119
• Código UNSPSC: 12164502
• ID de substância PubChem: 24901693
• Número de Flavis: 7.109
• NACRES: NA.21
• Organoléptico: musty; woody; sweet
• grau: FG; Fragrance grade; Halal; Kosher
• fonte biológica: synthetic
• Agency: follows IFRA guidelines; meets purity specifications of JECFA
• alérgeno alimentar: no known allergens

Propriedades

• fonte biológica: synthetic
• Nível de qualidade: 400
• grau: FG; Fragrance grade; Halal; Kosher
• Agency: follows IFRA guidelines; meets purity specifications of JECFA
• conformidade reg.: EU Regulation 1223/2009; EU Regulation 1334/2008 & 178/2002
• Ensaio: ≥98%
• índice de refração: n20/D 1.491 (lit.)
• p.e.: 222 °C (lit.); 92-94 °C/11 mmHg (lit.)
• pf: 26-28 °C (lit.)
• aplicação(ões): flavors and fragrances
• Documentação: see Safety & Documentation for available documents
• alérgeno alimentar: no known allergens
• alérgeno de fragrância: no known allergens
• Organoléptico: musty; woody; sweet
• cadeia de caracteres SMILES: 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
• chave InChI: AYJXHIDNNLJQDT-UHFFFAOYSA-N

Descrição

Descrição geral

4-Oxoisophorone is a flavor compound found in tobacco[1] and saffron.[2]

Aplicação

<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>

Informações de segurança

• Pictogramas: GHS07
• Palavra indicadora: Warning
• Frases de perigo: H317
• Declarações de precaução: P280 - P302 + P352
• Classificações de perigo: Skin Sens. 1
• Código de classe de armazenamento: 11 - Combustible Solids
• Classe de risco de água (WGK): WGK 1
• Equipamento de proteção individual: dust mask type N95 (US), Eyeshields, Faceshields, Gloves