Ethyl 2-fluoroacetoacetate 2-氟乙酰乙酸乙酯
CAS 1522-41-4 MFCD00215830
化学结构图
SMILES: CCOC(=O)C(F)C(C)=O
化学属性
| Mol. Formula | C6 |
|---|---|
| Mol. Weight | 148 |
| Boiling Point | 183 |
| Density | \u00091.181 |
| Refractive index | 1.4080 to 1.4140 |
| Flash Point | 90°C(lit.) |
别名和识别编码
| Chemical Name | Ethyl 2-fluoroacetoacetate |
|---|---|
| CAS Number | 1522-41-4 |
| Alfabeta Name | ETHYLFLUOROACETOACETATE 2- |
| MDL Number | MFCD00215830 |
| Synonym | 2-Fluoro-3-oxobutanoic acid ethyl ester, Ethyl 2-fluoro-3-oxobutanoate, Ethyl 2-fluoro-3-oxobutyrate, NSC 24563 (R,S)-2-Fluoro-3-oxo-butyric acid ethyl ester 2-FLUORO-3-OXO-BUTANOIC ACID ETHYL ESTER 2-FLUORO-3-OXO-BUTYRIC ACID ETHYL ESTER 2-Fluoracetessigsäureethylester 2-Fluoro-3-oxobutanoic acid ethyl ester 2-Fluoro-3-oxobutanoic acid ethyl ester Ethyl 2-fluoro-3-oxobutanoate Ethyl 2-fluoro-3-oxobutyrate NSC 24563 2-Fluoroacetoacetic Acid Ethyl Ester 2-fluoro-acetoacetic acid ethyl ester 2-氟-3-酮基丁酸乙酯 2-氟乙酰乙酸乙酯 Acetoacetic acid, 2-fluoro-, ethyl ester Acetoacetic acid, fluoro-, ethyl ester BUTYRIC ACID, 2-FLUORO-3-OXO-, ETHYL ESTER Butanoic acid, 2-fluoro-3 |
| PubChem Substance ID | 87560085 |
| Reaxys-RN | 1759115 |
| Beilstein Registry Number | 3(4)1546 |
| Chemical Name Translation | 2-氟乙酰乙酸乙酯 |
| InChIKey | SHTFQLHOTAJQRJ-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00115854 |
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分类
- Alkyl Fluorinated Building Blocks, Building Blocks, C6 to C7, Carbonyl Compounds, Chemical Synthesis, Esters, Fluorinated Building Blocks, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
- {SNA} Alkyl Fluorinated Building Blocks, Building Blocks, C6 to C7, Carbonyl Compounds, Chemical Synthesis, Esters, Fluorinated Building Blocks, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
- {uni_hamburg} no charge; ester; ketone; racemate; 1fragment
相关文献及参考
- 1. Lachia, M.; et al., Ethyl 2-(2-chloroethyl)acrylate: a new very versatile a-cyclopropylester cation synthon. Efficient synthesis of cyclopropane ester derivatives by Michael addition-induced cyclization reaction Tetrahedron Lett. 52 , 3219-3222, (2011)
- 2. Kang, Y. K.; et al., Asymmetric Mannich-type reactions of fluorinated ketoesters with binaphthyl-modified thiourea catalysts Bull. Korean Chem. Soc. 32 , 1195-1200, (2011)
- 3. Ullah, F.; et al., Enantioselective Organocatalytic Conjugate Addition of Fluorocarbon Nucleophiles to α,β-Unsaturated Aldehydes Chem. Eur. J. 15 , 10013-10017, (2009)
- Beil. 3 ,IV,1546
- Short: III/35B Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Fluorine-19 and Nitrogen-15 Author: Balasubramanian, M.; Gupta, R.R.; Jain, M.; Perumal, S. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35B Year: 1998 ISBN: 3-540-63275-1 ISBN: 978-3-540-63275-7 Internet Resource: DOI:10.1007/b55685 RefComment: VII, 242 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CO-ROM's.
安全信息
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
- P302+P350
- P302+P352+P332+P313+P362+P364
- P305+P351+P338
- P305+P351+P338+P337+P313
- P332+P313
- P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
- P403+P235
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- H315 Causes skin irritation 会刺激皮肤
- H319 Causes serious eye irritation 严重刺激眼睛
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- H227 Combustible liquid 可燃液体
GHS Symbol
- S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
- S36 Wear suitable protective clothing 穿戴适当的防护服；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
其他信息
- MOL 文件:1522-41-4.mol
- Acros Organics:2-氟乙酰羧酸乙酯 Ethyl 2-fluoroacetoacetate, 97%(1522-41-4)
- Hazard Note:Irritant
- TCI Shanghai:2-氟乙酰乙酸乙酯 Ethyl 2-Fluoroacetoacetate,>;94.0%(GC)(1522-41-4)
- Sigma Aldrich:1522-41-4(sigmaaldrich)
- 2-氟乙酰乙酸乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 F0471 2-氟乙酰乙酸乙酯 Ethyl 2-Fluoroacetoacetate 25G 785元 2010/06/21 378440250 2-氟乙酰乙酸乙酯 Ethyl 2-fluoroacetoacetate 97% 25 ML 505元
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