5-Methoxy-2-methylindole 5-甲氧基-2-甲基吲哚

CAS 1076-74-0 MFCD00005620

化学结构图

1076-74-0
SMILES: COc1ccc2[nH]c(C)cc2c1

化学属性

Mol. FormulaC10H11NO
Mol. Weight161.20
Density1.134
Melting Point86-88°C
TSCANo
Boiling Point308.5°C at 760 mmHg

别名和识别编码

Chemical Name5-Methoxy-2-methylindole
CAS Number1076-74-0
Alfabeta NameMETHOXYMETHYLINDOLE H521-----
MDL NumberMFCD00005620
Synonym 5-Methoxy-2-methyl-1H-indole {LY} 5-Methoxy-2-methyl-1H-indole {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Methoxy-2-methyl-1H-indole
EC Number214-066-5
Beilstein Registry Number118538
PubChem Substance ID70642
Reaxys-RN118538
Chemical Name Translation5-甲氧基-2-甲基吲哚
InChIKeyVSWGLJOQFUMFOQ-UHFFFAOYSA-N
LabNetwork Molecule IDLN00140693
InChIInChI=1S/C10H11NO/c1-7-5-8-6-9(12-2)3-4-10(8)11-7/h3-6,11H,1-2H3
Canonical SMILESCC(N1)=CC2=C1C=CC(OC)=C2
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分类

  • Inhibitors
  • Heterocycles
  • Pharmaceuticals
  • Intermediates & Fine Chemicals
  • {SNA} Building Blocks, C10, Chemical Synthesis, Heterocyclic Building Blocks, Indoles
  • Aromatics

产品应用

  • An indole derivative shown to be an effective inhibitor of the chlorinating activity of myeloperoxidase (MPO). Used in the metabolic synthesis of arylacetic acid antiinflammatory synthesis.

相关文献及参考

  • Beilstein:21(2)47
  • Ximenes, V.F. et al.: Braz. J. Med. Bio. Res., 38, 1575 (2005); Gillard, J.W. et al.: J. Med. Chem., 30, 2051 (1987);

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
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；
  • S36/37/39 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；
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/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
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。
  • 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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
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

  • Acros Organics:5-甲氧基-2-甲基吲哚 5-Methoxy-2-methylindole, 99+%(1076-74-0)
  • Alfa Aesar:5-甲氧基-2-甲基吲哚,99+% 5-Methoxy-2-methylindole, 99+%(1076-74-0)
  • MOL 文件:1076-74-0.mol
  • 5-甲氧基-2-甲基吲哚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M0730 5-甲氧基-2-甲基吲哚 5-Methoxy-2-methylindole 1G 500元 2014/06/02 M0730 5-甲氧基-2-甲基吲哚 5-Methoxy-2-methylindole 5G 1770元 2010/06/21 125940050 5-甲氧基-2-甲基吲哚 5-Methoxy-2-methylindole 99+% 5 GR 1307元
  • TCI Shanghai:5-甲氧基-2-甲基吲哚 5-Methoxy-2-methylindole,>;99.0%(GC)(1076-74-0)
  • Sigma Aldrich:1076-74-0(sigmaaldrich)
  • 检测方法:HPLC,NMR
  • 上游原料:丙酮 --> 碳酸氢钠 --> 氯化锌 --> 4-甲氧基苯肼盐酸盐
  • 图谱信息:5-甲氧基-2-甲基吲哚(1076-74-0)质谱(MS) 5-甲氧基-2-甲基吲哚(1076-74-0)核磁图( 13 CNMR) 5-甲氧基-2-甲基吲哚(1076-74-0)红外图谱(IR1) 5-甲氧基-2-甲基吲哚(1076-74-0)核磁图( 1 HNMR) 5-甲氧基-2-甲基吲哚(1076-74-0)红外图谱(IR2)

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. Indazoles 吲唑
  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. Indoles 吲哚
  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. Indolines 吲哚啉
  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. Indoles 吲哚
  5. C10 - Indoles
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Indoles

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