218456

3-甲基-2-氧代丁酰乙酯

97%

• 同義詞: 3-甲基-2-氧代丁酸乙酯, 3-甲基-2-酮丁酸乙酯
• 線性公式: (CH₃)₂CHCOCOOCH₂CH₃
• CAS號碼: 20201-24-5
• 分子量：: 144.17
• Beilstein: 1756668
• EC號碼: 243-587-0
• MDL號碼: MFCD00009122
• 分類程式碼代碼: 12352100
• PubChem物質ID: 24853067
• NACRES: NA.22

屬性

• 化驗: 97%
• 折射率: n20/D 1.410 (lit.)
• bp: 62 °C/11 mmHg (lit.)
• 密度: 0.989 g/mL at 25 °C (lit.)
• 官能基: ester; ketone
• 儲存溫度: 2-8°C
• SMILES 字串: CCOC(=O)C(=O)C(C)C
• InChI: 1S/C7H12O3/c1-4-10-7(9)6(8)5(2)3/h5H,4H2,1-3H3
• InChI 密鑰: CKTYYUQUWFEUCO-UHFFFAOYSA-N

描述

一般說明

Ethyl 3-methyl-2-oxobutyrate reacts with a variety of allyl halides in the presence of indium to afford hydroxy unsaturated carbonyl compounds[1]. Conformational behaviour of ethyl 3-methyl-2-oxobutyrate was investigated using solution FTIR in combination with ab initio calculations[2].

應用

Ethyl 3-methyl-2-oxobutyrate was used in the synthesis of (2SR,4SR)-5(S)-(N-Boc)-amino-6-cyclohexyl-4-hydoxy-2-isopropyl hexanoic acid[3].

安全資訊

• 象形圖: GHS02
• 訊號詞: Warning
• 危險聲明: H226
• 防範說明: P210 - P233 - P240 - P241 - P242 - P243
• 危險分類: Flam. Liq. 3
• 儲存類別代碼: 3 - Flammable liquids
• 水污染物質分類（WGK）: WGK 3
• 閃點（°F）: 109.4 °F - closed cup
• 閃點（°C）: 43 °C - closed cup
• 個人防護裝備: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter