Diethyl allylmalonate 二乙基丙烯基丙二酸酯

CAS 2049-80-1 MFCD00009155

化学结构图

2049-80-1
SMILES: C=CCC(C(=O)OCC)C(=O)OCC

化学属性

Mol. FormulaC10H16O4
Mol. Weight200.23
Density1.015
Refractive index1.4290 to 1.4320
Flash Point92°C(lit.)
TSCAYes
Boiling Point222-223 °C at 760 mmHg
Appearance 无色透明液体，沸点222-223℃，密度 1.015 ;g/mL ;at 25 ;°C，折光系数 n 20/D 1.431，闪点 160 ;°F

别名和识别编码

Chemical NameDiethyl allylmalonate
Synonym Diethyl allylmalonate {LY} Diethyl allylmalonate {} {LY} Diethyl allylmalonate {} {} {LY} Diethyl allylmalonate {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl allylmalonate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00009155
CAS Number2049-80-1
EC Number218-072-9
Beilstein Registry Number1709466
PubChem Substance ID74900
Reaxys-RN1709466
Chemical Name Translation二乙基丙烯基丙二酸酯
InChIKeyGDWAYKGILJJNBB-UHFFFAOYSA-N
LabNetwork Molecule IDLN00116149
Canonical SMILESO=C(C(CC=C)C(OCC)=O)OCC
InChIInChI=1S/C10H16O4/c1-4-7-8(9(11)13-5-2)10(12)14-6-3/h4,8H,1,5-7H2,2-3H3
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分类

  • {uni_hamburg} no charge; ester; 1fragment
  • {SNA} Allyl Monomers, Monomers, Polymer Science, 材料科学
  • {SNA} Allyl Monomers, Materials Science, Monomers, Polymer Science
  • {SNA} Building Blocks, C10 to C11, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

相关文献及参考

  • Alkylation at the one available acidic hydrogen, followed by removal of the allyl group with the reagent (2-propene)Ti(O-i-Pr)2, readily prepared from Ti(O-i-Pr)4 and i-PrMgCl, gives the mono-alkyl malonate. Diethyl allylmalonate can thus be regarded as a mono-protected form of diethyl malonate: J. Org. Chem., 61, 2266 (1996):
  • Short: II/27B
  • Short: III/38B

安全信息

Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Safety Statements
  • 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；
  • S37 Wear suitable gloves 戴适当手套；
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
GHS Symbol
WGK Germany3
Hazard statements
  • H227 Combustible liquid 可燃液体
  • 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
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Precautionary statements
  • 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。
  • P264+P265
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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+P352
  • P304+P340
  • P305+P351+P338
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P370+P378
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Hazard Codes Xi
UN Number
Packing GroupIII
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitro

其他信息

  • MSDS 信息:Diethyl allylmalonate(2049-80-1).msds
  • Alfa Aesar:烯丙基丙二酸二乙酯,97% Diethyl allylmalonate, 97%(2049-80-1)
  • 图谱信息:烯丙基丙二酸二乙酯(2049-80-1)红外图谱(IR1) 烯丙基丙二酸二乙酯(2049-80-1)质谱(MS) 烯丙基丙二酸二乙酯(2049-80-1)Raman光谱 烯丙基丙二酸二乙酯(2049-80-1)核磁图( 13 CNMR) 烯丙基丙二酸二乙酯(2049-80-1)核磁图( 1 HNMR)
  • 用途二:用作医药和原料和农药中间体。
  • 用途一:用作医药的原料和农药中间体
  • 烯丙基丙二酸二乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A0231 烯丙基丙二酸二乙酯 Diethyl Allylmalonate 25G 448元 2014/06/02 A0231 烯丙基丙二酸二乙酯 Diethyl Allylmalonate 500G 4280元 2010/06/21 113960050 烯丙基丙二酸二乙酯 Diethyl allylmalonate 97% 5 GR 229元
  • MOL 文件:2049-80-1.mol
  • TCI Shanghai:烯丙基丙二酸二乙酯 Diethyl Allylmalonate,>;98.0%(GC)(2049-80-1)
  • Sigma Aldrich:2049-80-1(sigmaaldrich)
  • 海关编码:29171990
  • Acros Organics:烯丙基丙二酸二乙酯 Diethyl allylmalonate, 97%(2049-80-1)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C10 to C11 - Esters
  1. Materials Science 材料科学
  2. Products for Polymer Science Research
  3. Monomers - Polymer Science
  4. Allyl Monomers - Monomers
  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Cell Signaling and Neuroscience - Cell Biology
  4. Kinase/Phosphatase Biology - Cell Signaling and Neuroscience
  5. Serine/Threonine Kinase Biology - Kinase/Phosphatase Biology
  6. Serine/Threonine Kinase Inhibitors - Serine/Threonine Kinase Biology
  7. Phosphatidylinositol 3-kinase (PI3K) - Serine/Threonine Kinase Inhibitors
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Monomers
  4. Alcohols

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