559059

(4-三氟甲基苯甲酰基)乙酸乙酯

• 别名: 3-Oxo-3-(4-trifluoromethylphenyl)propanoic acid ethyl ester, Ethyl 2-4-(Trifluoromethyl)benzoylacetate, Ethyl 3-(4-trifluoromethylphenyl)-3-oxopropionate, Ethyl 3-oxo-3-4-(trifluoromethyl)phenylpropanoate
• 线性分子式: CF₃C₆H₄COCH₂CO₂C₂H₅
• CAS号: 106263-53-0
• 分子量: 260.21
• MDL號碼: MFCD03424818
• 分類程式碼代碼: 12352100
• PubChem物質ID: 24879790
• NACRES: NA.22

属性

• 折射率: n20/D 1.4880 (lit.)
• bp: 248-249 °C (lit.)
• 密度: 1.270 g/mL at 25 °C (lit.)
• SMILES 字串: CCOC(=O)CC(=O)c1ccc(cc1)C(F)(F)F
• InChI: 1S/C12H11F3O3/c1-2-18-11(17)7-10(16)8-3-5-9(6-4-8)12(13,14)15/h3-6H,2,7H2,1H3
• InChI 密鑰: HVHVSJPSNQIPEM-UHFFFAOYSA-N

说明

應用

Ethyl (4-trifluoromethylbenzoyl)acetate may be used to synthesize 2-(carboethoxy)-3-(4′-trifluoromethyl)phenylquinoxaline 1,4-dioxide and N-cyclohexyl-4-methoxy-6-(4-(trifluoromethyl)phenyl)pyrimidin-2-amine.

Reactant for:

• In-catalyzed cycloisomerization
• Chiral Lewis base-catalyzed stereoselective reduction with trichlorosilane and water
• Guanidine-catalyzed enantioselective Michael reactions
• Transesterification reactions
• Intermolecular coupling reactions

安全信息

• 儲存類別代碼: 10 - Combustible liquids
• 水污染物質分類（WGK）: WGK 3
• 閃點（°F）: Not applicable
• 閃點（°C）: Not applicable
• 個人防護裝備: Eyeshields, Gloves