W241512

Ethyl acetoacetate

natural, ≥97%, FG

• Synonim(y): Acetoacetic ester
• Wzór liniowy: CH₃COCH₂COOC₂H₅
• Numer CAS: 141-97-9
• Masa cząsteczkowa: 130.14
• Numer FEMA: 2415
• Beilstein: 385838
• Numer WE: 205-516-1
• Nr Rady Europy: 240c
• Numer MDL: MFCD00009199
• Kod UNSPSC: 12164502
• Identyfikator substancji w PubChem: 24901056
• Numer Flavisa: 9.402
• NACRES: NA.21
• agency: follows IFRA guidelines

Właściwości

• klasa czystości: FG; Fragrance grade; Halal; Kosher; natural
• Poziom jakości: 400
• agency: follows IFRA guidelines
• zgodność regionalna: EU Regulation 1223/2009; EU Regulation 1334/2008 & 178/2002; FDA 21 CFR 117
• gęstość pary: 4.48 (vs air)
• ciśnienie pary: 1 mmHg ( 28.5 °C)
• Próba: ≥97%
• temp. samozapłonu: 580 °F
• granice wybuchowości: 9.5 %
• charakterystyka ekologicznej alternatywy: Less Hazardous Chemical Syntheses; Use of Renewable Feedstocks; Learn more about the Principles of Green Chemistry.
• sustainability: Greener Alternative Product
• współczynnik refrakcji: n20/D 1.418-1.421
• bp: 181 °C (lit.)
• mp: −43 °C (lit.)
• rozpuszczalność: water: soluble 35 part; organic solvents: soluble
• gęstość: 1.029 g/mL at 20 °C (lit.)
• Zastosowanie: flavors and fragrances
• Dokumentacja: see Safety & Documentation for available documents
• alergen pokarmowy: no known allergens
• alergen zapachowy: no known allergens
• kategoria ekologicznej alternatywy: Aligned
• Organoleptyczne: apple; fatty; green; fruity
• ciąg SMILES: CCOC(=O)CC(C)=O
• InChI: 1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3
• Klucz InChI: XYIBRDXRRQCHLP-UHFFFAOYSA-N

Opis

Opis ogólny

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”.

Zastosowanie

• 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).

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Informacja o środkach bezpieczeństwa

• Kod klasy składowania: 10 - Combustible liquids
• Klasa zagrożenia wodnego (WGK): WGK 1
• Temperatura zapłonu (°F): 164.3 °F - closed cup
• Temperatura zapłonu (°C): 73.5 °C - closed cup
• Środki ochrony indywidualnej: Eyeshields, Gloves, type ABEK (EN14387) respirator filter