16797

3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one

analytical standard

• Sinónimos: α-Cetone, Isomethyl-α-ionone
• Fórmula empírica (notación de Hill): C₁₄H₂₂O
• Número de CAS: 127-51-5
• Peso molecular: 206.32
• Número CE: 204-846-3
• Número MDL: MFCD00034582
• Código UNSPSC: 85151701
• ID de la sustancia en PubChem: 329751380
• NACRES: NA.24

Propiedades

• grado: analytical standard
• Nivel de calidad: 100
• Ensayo: ≥90.0% (GC)
• caducidad: limited shelf life, expiry date on the label
• índice de refracción: n20/D 1.495-1.505
• densidad: 0.93 g/mL at 20 °C (lit.)
• aplicaciones: cleaning products; cosmetics; flavors and fragrances; food and beverages; personal care
• Formato: neat
• cadena SMILES: CC(=O)C(\C)=C\C1C(C)=CCCC1(C)C
• InChI: 1S/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h7,9,13H,6,8H2,1-5H3/b11-9+
• Clave InChI: JRJBVWJSTHECJK-PKNBQFBNSA-N

Descripción

Descripción general

3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one is a fragrance compound primarily utilized in personal care products, including cosmetics, shampoos, deodorants, air fresheners, etc. It is a well-known fragrance allergen known to induce allergic contact dermatitis and rashes.

Aplicación

3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one may be used as an analytical reference standard for the determination of the analyte in perfumes, leave-on cosmetics, commercial scented products, and fragrance raw materials/perfume oils by various chromatography techniques.

Información de seguridad

• Pictogramas: GHS09
• Frases de peligro: H411
• Consejos de prudencia: P273 - P391 - P501
• Clasificaciones de peligro: Aquatic Chronic 2
• Código de clase de almacenamiento: 10 - Combustible liquids
• Clase de riesgo para el agua (WGK): WGK 2
• Punto de inflamabilidad (°F): 230.5 °F - closed cup
• Punto de inflamabilidad (°C): 110.3 °C - closed cup