Ethyl 3-bromopropionate 3-溴丙酸乙酯

CAS 539-74-2 MFCD00000251

化学结构图

539-74-2
SMILES: CCOC(=O)CCBr

化学属性

Mol. FormulaC5H9BrO2
Mol. Weight181.03
Refractive index1.4510 to 1.4540
Boiling Point179°C at 760 mmHg
Density1.412 g/mL at 25 °C(lit.)
Flash Point70°C
TSCAYes
Solubility与乙醇、乙醚相混溶,不溶于水。
Stability对光敏感
Appearance 无色液体。有刺激气味,见光变黄。 与乙醇、乙醚相混溶,不溶于水。
Melting Point184-186 °C

别名和识别编码

Chemical NameEthyl 3-Bromopropanoate
CAS Number539-74-2
PubChem Substance ID68320
EC Number208-724-0
Beilstein Registry Number2,256
MDL NumberMFCD00000251
Reaxys-RN1700933
Synonym Ethyl 3-bromopropanoate {LY} Ethyl 3-bromopropanoate {} {LY} Ethyl 3-bromopropanoate {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-bromopropanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY}
Chemical Name Translation3-溴丙酸乙酯
LabNetwork Molecule IDLN00009027
InChIInChI=1S/C5H9BrO2/c1-2-8-5(7)3-4-6/h2-4H2,1H3
Canonical SMILESCCOC(=O)CCBr
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分类

  • {uni_hamburg} no charge; ester; 1fragment
  • Building Blocks, C2 to C5, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
  • {SNA} Building Blocks, C2 to C5, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

产品应用

  • Ethyl 3-bromopropionate was used in the preparation of (3′,4′-dimethoxyphenyl)-5-oxopentanoic acid.

相关文献及参考

  • Merck: 14,1433
  • Merck: 14,1433 Beilstein:2,256
  • Short: III/47
  • Short: III/38B
  • Cyclopropanols may be synthesized by reaction of ß-halo esters with Grignard reagents and SmI2: Tetrahedron Lett., 32, 7691 (1991).
  • Undergoes a "homo-Reformatsky" coupling with carbonyl compounds leading to -lactones. The homoenolate can be generated with various lanthanide metals, La, Ce, Nd or Sm: J. Org. Chem., 55, 1628 (1990):

安全信息

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
Hazard Codes Xi
Precautionary statements
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前,切勿操作。
  • 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+P350
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P308+P313
  • 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 Store in a well-ventilated place. 储存在通风良好的地方。
  • P403+P233
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
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;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • S37 Wear suitable gloves 戴适当手套;
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 下游产品:1-(3-(吡咯烷-1-基)丙基)肼 --> 1-哌啶丙酸
  • 上游原料:3-溴丙酸
  • 3-溴丙酸乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B0647 3-溴丙酸乙酯 Ethyl 3-Bromopropionate 500G 4920元 2014/06/02 B0647 3-溴丙酸乙酯 Ethyl 3-Bromopropionate 25G 568元 2010/06/21 409815000 3-溴丙酸乙酯 Ethyl 3-bromopropionate 99% 500 GR 8744元
  • TCI Shanghai:3-溴丙酸乙酯 Ethyl 3-Bromopropionate,>;98.0%(GC)(539-74-2)
  • 用途一:用作有机合成试剂
  • 图谱信息:3-溴丙酸乙酯(539-74-2)Raman光谱 3-溴丙酸乙酯(539-74-2)核磁图( 1 HNMR) 3-溴丙酸乙酯(539-74-2)红外图谱(IR2) 3-溴丙酸乙酯(539-74-2)质谱(MS) 3-溴丙酸乙酯(539-74-2)核磁图( 13 CNMR) 3-溴丙酸乙酯(539-74-2)红外图谱(IR1)
  • Sigma Aldrich:539-74-2(sigmaaldrich)
  • Acros Organics:3-溴丙酸乙酯 Ethyl 3-bromopropionate, 99%(539-74-2)
  • 用途二:用作有机合成中间体。
  • 方法一:由β-溴丙酸与乙醇酯化而得。
  • 敏感性:Light Sensitive
  • 与乙醇、乙醚混溶,不溶于水,遇光变黄。
  • Alfa Aesar:3-溴丙酸乙酯,99% Ethyl 3-bromopropionate, 99%(539-74-2)
  • MOL 文件:539-74-2.mol

系列性分类


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