3,5-Dimethylpyrrole-2-Carboxaldehyde 3,5-二甲基-2-吡咯甲醛

CAS 2199-58-8 MFCD00111522

化学结构图

2199-58-8
SMILES: Cc1cc(C)c(C=O)[nH]1

化学属性

Mol. FormulaC7H9NO
Mol. Weight123.15
TSCANo
Melting Point95-99°C
Density1.422
Stability对空气敏感
Boiling Point237.3±35.0 °C at 760 mmHg

别名和识别编码

Chemical Name3,5-Dimethylpyrrole-2-Carboxaldehyde
CAS Number2199-58-8
Alfabeta NameDIMETHYLPYRROLECARBOXALDEHYDE H3512-----,
MDL NumberMFCD00111522
Synonym 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5-Dimethyl-1H-pyrrole-2-carbaldehyde {} {} {} {} {} {}
PubChem Substance ID270465
Reaxys-RN111299
Beilstein Registry Number21(5)7,226
EC Number250-023-7
Chemical Name Translation3,5-二甲基-2-吡咯甲醛
LabNetwork Molecule IDLN00004042
InChIInChI=1S/C7H9NO/c1-5-3-6(2)8-7(5)4-9/h3-4,8H,1-2H3
Canonical SMILESO=CC1=C(C)C=C(C)N1
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分类

  • Intermediates
  • Aromatics
  • Heterocycles
  • {SNA} Aldehydes, Building Blocks, C7, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Organic Building Blocks, Pyrroles

产品应用

  • Intermediate used in the synthesis of a series of anaplastic lymphoma kinase (ALK) inhibitors, a new target for therapy of non-small-cell lung cancer (NSCLC).

相关文献及参考

  • Okamoto, M., et al.: Bioorg. Med. Chem. Lett., 19, 3086 (2011),

安全信息

Warnings IRRITANT
Safety Statements
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • 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 Wear suitable gloves 戴适当手套;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
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
Storage condition -20°C, sealed storage, away from moisture {LY} -20°C, sealed storage, away from moisture 2-8°C Air Sensitive {} {LY} -20°C, sealed storage, away from moisture {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed s
WGK Germany3
GHS Symbol
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P305+P351+P338
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
  • P302+P352+P332+P313+P362+P364
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
Signal word
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi

其他信息

  • MOL 文件:2199-58-8.mol
  • 3,5-二甲基-2-吡咯甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D3950 3,5-二甲基-2-吡咯甲醛 3,5-Dimethyl-2-pyrrolecarboxaldehyde 1G 868元 2014/06/02 D3950 3,5-二甲基-2-吡咯甲醛 3,5-Dimethyl-2-pyrrolecarboxaldehyde 5G 3050元 2010/06/21 CC18004DE 3,5-二甲基-2-吡咯甲醛 3,5-dimethyl-1H-pyrrole-2-carbaldehyde 5 GR 6240元
  • Alfa Aesar:3,5-二甲基-1-吡咯2-甲醛 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde(2199-58-8)
  • Acros Organics:3,5-dimethyl-1H-pyrrole-2-carbaldehyde(2199-58-8)
  • Sigma Aldrich:2199-58-8(sigmaaldrich)

系列性分类


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