1-(4-Nitrophenyl)-1H-pyrrole, 97% 1-(4-硝基苯基)-1H-吡咯

CAS 4533-42-0 MFCD00119340

化学结构图

4533-42-0
SMILES: O=[N+]([O-])c1ccc(-n2cccc2)cc1

化学属性

Mol. FormulaC10H8N2O2
Mol. Weight188.19
Melting Point180-183°C
Boiling Point327.7°C at 760 mmHg

别名和识别编码

Chemical Name1-(4-Nitrophenyl)-1H-pyrrole, 97%
CAS Number4533-42-0
Alfabeta NameNITROPHENYLPYRROLE H141()----
MDL NumberMFCD00119340
PubChem Substance ID272431
Reaxys-RN154066
Beilstein Registry Number154066
Chemical Name Translation1-(4-硝基苯基)-1H-吡咯
Synonym 1-(4-Nitrophenyl)-1H-pyrrole {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Nitrophenyl)-1H-pyrrole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
InChIKeyPWCFKNYSCGRNRW-UHFFFAOYSA-N
LabNetwork Molecule IDLN00146964
InChIInChI=1S/C10H8N2O2/c13-12(14)10-5-3-9(4-6-10)11-7-1-2-8-11/h1-8H
Canonical SMILESC2=C([N]1C=CC=C1)C=CC(=C2)[N+](=O)[O-]
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分类

  • {KO} Nitros
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Pyrroles

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
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 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 Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • 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；
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 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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
2
Rotatable Bonds
1
H-bond Donors
0
LogP
3

其他信息

  • 图谱信息:1-(4-硝基苯基)-1H-吡咯(4533-42-0)红外图谱(IR2) 1-(4-硝基苯基)-1H-吡咯(4533-42-0)红外图谱(IR1) 1-(4-硝基苯基)-1H-吡咯(4533-42-0)质谱(MS)
  • TCI Shanghai:1-(4-硝基苯基)吡咯 1-(4-Nitrophenyl)pyrrole,>;98.0%(GC)(4533-42-0)
  • 1-(4-硝基苯基)-1H-吡咯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 N0584 1-(4-硝基苯基)吡咯 1-(4-Nitrophenyl)pyrrole 1G 1410元
  • Sigma Aldrich:4533-42-0(sigmaaldrich)
  • MOL 文件:4533-42-0.mol

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. Materials Science 材料科学
  2. Reagents for Conducting Polymer Research

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