W241512

乙酰乙酸乙酯

natural, ≥97%, FG

• 别名: 乙酰醋酸乙酯
• 线性分子式: CH₃COCH₂COOC₂H₅
• CAS号: 141-97-9
• 分子量: 130.14
• FEMA號碼: 2415
• Beilstein: 385838
• EC號碼: 205-516-1
• 歐洲委員會號碼: 240c
• MDL號碼: MFCD00009199
• 分類程式碼代碼: 12164502
• PubChem物質ID: 24901056
• Flavis號碼: 9.402
• NACRES: NA.21

属性

• 等級: FG; Fragrance grade; Halal; Kosher; natural
• 品質等級: 400
• agency: follows IFRA guidelines
• 法律遵循: EU Regulation 1223/2009; EU Regulation 1334/2008 & 178/2002; FDA 21 CFR 117
• 蒸汽密度: 4.48 (vs air)
• 蒸汽壓力: 1 mmHg ( 28.5 °C)
• 化驗: ≥97%
• 自燃溫度: 580 °F
• expl. lim.: 9.5 %
• 環保替代產品特色: Less Hazardous Chemical Syntheses; Use of Renewable Feedstocks; Learn more about the Principles of Green Chemistry.
• sustainability: Greener Alternative Product
• 折射率: n20/D 1.418-1.421
• bp: 181 °C (lit.)
• mp: −43 °C (lit.)
• 溶解度: water: soluble 35 part; organic solvents: soluble
• 密度: 1.029 g/mL at 20 °C (lit.)
• 應用: flavors and fragrances
• 文件: see Safety & Documentation for available documents
• 食物過敏原: no known allergens
• 香料過敏原: no known allergens
• 環保替代類別: Aligned
• 感官的: apple; fatty; green; fruity
• SMILES 字串: CCOC(=O)CC(C)=O
• InChI: 1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3
• InChI 密鑰: XYIBRDXRRQCHLP-UHFFFAOYSA-N

说明

一般說明

We are committed to bringing you Greener Alternative Products, which adhere to one of the four categories of Greener Alternatives . This product is a Biobased products, showing key improvements in Green Chemistry Principles “Less Hazardous Chemical Syntheses” and “Use of Renewable Feedstock”.

應用

• Benchtop (19)F Nuclear Magnetic Resonance (NMR) Spectroscopy Provides Mechanistic Insight into the Biginelli Condensation toward the Chemical Synthesis of Novel Trifluorinated Dihydro- and Tetrahydropyrimidinones as Antiproliferative Agents.: This study explores the use of Ethyl acetoacetate in the synthesis of novel trifluorinated compounds with potential antiproliferative properties against cancer cells. The research employs advanced NMR spectroscopy to elucidate the reaction mechanism (Chen et al., 2023, Chen et al., 2023).


• Synthesis and Characterization of New Dihydronaphthalene Candidates as Potent Cytotoxic Agents against MCF-7 Human Cancer Cells.: This article discusses the creation of dihydronaphthalene derivatives using Ethyl acetoacetate, highlighting their significant cytotoxic activity against breast cancer cells. The synthesized compounds show promise for further development as chemotherapeutic agents (Ahmed et al., 2020, Ahmed et al., 2020).


• Synthesis and characterization of new 4H-chromene-3-carboxylates ensuring potent elastase inhibition activity along with their molecular docking and chemoinformatics properties.: Utilizing Ethyl acetoacetate, this research focuses on developing 4H-chromene derivatives that exhibit strong elastase inhibition, a key enzyme implicated in various inflammatory diseases. The study integrates molecular docking and chemoinformatics for detailed analysis (Dige et al., 2020, Dige et al., 2020).

安全信息

• 儲存類別代碼: 10 - Combustible liquids
• 水污染物質分類（WGK）: WGK 1
• 閃點（°F）: 164.3 °F - closed cup
• 閃點（°C）: 73.5 °C - closed cup
• 個人防護裝備: Eyeshields, Gloves, type ABEK (EN14387) respirator filter