E41206

4-硝基苯甲酰乙酸乙酯

• 同義詞: (p-Nitrobenzoyl)acetic acid ethyl ester, Ethyl 3-oxo-3-(4-nitrophenyl)propanoate, NSC 62134
• 線性公式: O₂NC₆H₄COCH₂CO₂C₂H₅
• CAS號碼: 838-57-3
• 分子量：: 237.21
• EC號碼: 212-656-7
• MDL號碼: MFCD00007357
• 分類程式碼代碼: 12352100
• PubChem物質ID: 24894540
• NACRES: NA.22

屬性

• mp: 71-73 °C (lit.)
• SMILES 字串: CCOC(=O)CC(=O)c1ccc(cc1)[N+]([O-])=O
• InChI: 1S/C11H11NO5/c1-2-17-11(14)7-10(13)8-3-5-9(6-4-8)12(15)16/h3-6H,2,7H2,1H3
• InChI 密鑰: NGRXSVFCLHVGKU-UHFFFAOYSA-N

描述

應用

Reactant involved in:

• Synthesis of β-1,3-dicarbonyl aldehydes via oxidation
• Knoevenagel condensation using a lysine catalyst
• Cycloisomerization fo rthe synthesis of trisubstituted furans
• Fluorination by HF and iodosylbenzene
• Intramolecular Michael addition reactions for synthesis of benzylbutyrolactones
• Synthesis of diols via reduction of aromatic and aliphatic ketos esters
• Cross-coupling reactions for stereoselective synthesis of unsymmetrical 1,4-enediones

安全資訊

• 儲存類別代碼: 11 - Combustible Solids
• 水污染物質分類（WGK）: WGK 2
• 閃點（°F）: Not applicable
• 閃點（°C）: Not applicable