559180

Ethyl (3-methylbenzoyl)acetate

• 동의어(들): 3-Oxo-3-(m-tolyl)propionic acid ethyl ester, Ethyl 2-(3-methylbenzoyl)acetate, Ethyl 3-oxo-3-(m-tolyl)propanoate, Ethyl 3-oxo-3-(m-tolyl)propionate, Ethyl m-methylbenzoylacetate, Ethyl m-toluoylacetate
• Linear Formula: CH₃C₆H₄COCH₂CO₂CH₂CH₃
• CAS Number: 33166-79-9
• Molecular Weight: 206.24
• MDL number: MFCD03424816
• UNSPSC 코드: 12352100
• PubChem Substance ID: 24879802
• NACRES: NA.22

속성

• refractive index: n20/D 1.5290 (lit.)
• Quality Level: 100
• bp: 273-274 °C (lit.)
• density: 1.083 g/mL at 25 °C (lit.)
• 작용기: ester; ketone
• SMILES string: CCOC(=O)CC(=O)c1cccc(C)c1
• InChI: 1S/C12H14O3/c1-3-15-12(14)8-11(13)10-6-4-5-9(2)7-10/h4-7H,3,8H2,1-2H3
• InChI key: LLFKVNDSLHMEQC-UHFFFAOYSA-N

설명

애플리케이션

Reactant for:

• Stereoselective ketonization-olefination of indoles by Co/Mn-mediated oxidative cross-coupling of indoles via dioxygen activation
• Enantioselective Michael reaction
• SEGPhos-ruthenium-catalyzed asymmetric hydrogenation

안전성 정보

• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point (°F): Not applicable
• Flash Point (°C): Not applicable
• 개인 보호 장비: Eyeshields, Gloves