Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate 2,4-二甲基吡咯-3,5-二羧酸二乙酯

CAS 2436-79-5 MFCD00005218

化学结构图

2436-79-5
SMILES: CCOC(=O)c1[nH]c(C)c(C(=O)OCC)c1C

化学属性

Mol. FormulaC12H17NO4
Mol. Weight239.27
Density1.422
Melting Point135-136°C
TSCANo
Boiling Point372.3°C at 760 mmHg
Flash Point179°C

别名和识别编码

Chemical NameDiethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
MDL NumberMFCD00005218
CAS Number2436-79-5
EC Number219-431-2
Beilstein Registry Number194631
Synonym Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {} {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3,5-dimethyl-1H-pyrrole-2,4-dica
PubChem Substance ID75526
Reaxys-RN194631
Chemical Name Translation2,4-二甲基吡咯-3,5-二羧酸二乙酯
InChIKeyXSBSXJAYEPDGSF-UHFFFAOYSA-N
LabNetwork Molecule IDLN00227183
InChIInChI=1S/C12H17NO4/c1-5-16-11(14)9-7(3)10(13-8(9)4)12(15)17-6-2/h13H,5-6H2,1-4H3
Canonical SMILESO=C(C1=C(C)C(C(OCC)=O)=C(C)N1)OCC
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分类

  • {SNA} Bioactive Small Molecules, Building Blocks, Cell Biology, Chemical Synthesis,
  • {SNA} Bioactive Small Molecule Alphabetical Index, Building Blocks, Chemical Synthesis, D-DIF, Heterocyclic Building Blocks, Pyrroles, 生物活性小分子, 细胞生物学
  • {SNA} Building Blocks, Chemical Synthesis, D-DIF, Heterocyclic Building Blocks, Pyrroles,
  • {SNA} Bioactive Small Molecules, Building Blocks, Chemical Synthesis, D-DIF, Heterocyclic Building Blocks, Pyrroles, 细胞生物学
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks,

安全信息

Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
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
Precautionary statements
  • 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。
  • P301+P312
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P317
  • P337+P317
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Hazard Codes Xi
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Hazard statements
  • 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

其他信息

  • Alfa Aesar:2,4-二甲基吡咯-3,5-二羧酸二乙酯,97% Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate, 97%(2436-79-5)
  • MOL 文件:2436-79-5.mol
  • Sigma Aldrich:2436-79-5(sigmaaldrich)
  • Hazard Note:Irritant
  • Acros Organics:2,4-二甲基吡咯-3，5-二羧酸二乙酯 Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate, 97%(2436-79-5)
  • 2,4-二甲基吡咯-3,5-二羧酸二乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 BTB09314EA 2,4-二甲基吡咯-3,5-二羧酸二乙酯 diethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate 10 GR 840元 2010/06/21 114280250 2,4-二甲基吡咯-3,5-二羧酸二乙酯 Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate 97% 25 GR 1511元 2010/06/21 114280050 2,4-二甲基吡咯-3,5-二羧酸二乙酯 Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate 97% 5 GR 484元
  • MSDS 信息:3,5-Dimethyl-1H-Pyrrole-2,4-dicarboxylic acid diethyl ester(2436-79-5).msds
  • 检测方法:HPLC,NMR

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Pyrroles 吡咯
  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Oxidation - Synthetic Reagents
  4. Peroxides - Oxidation

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