4-Bromo-1H-Pyrrole-2-Carboxylic Acid 4-溴-1H-吡咯-2-羧酸

CAS 27746-02-7 MFCD00832862

化学结构图

27746-02-7
SMILES: OC(=O)C1=CC(Br)=CN1

化学属性

Mol. FormulaC5H4BrNO2
Mol. Weight189.99
Melting Point168-170°C
Boiling Point393°C at 760 mmHg

别名和识别编码

Chemical Name4-Bromo-1H-Pyrrole-2-Carboxylic Acid
CAS Number27746-02-7
Alfabeta NameBROMOPYRROLECARBOXYLICACID H412-----
MDL NumberMFCD00832862
Synonym 4-Bromo-1H-pyrrole-2-carboxylic acid {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Bromo-1H-pyrrole-2-carboxylic a
Chemical Name Translation4-溴-1H-吡咯-2-羧酸
LabNetwork Molecule IDLN00149251
Canonical SMILESO=C(C1=CC(Br)=CN1)O
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分类

  • {KO} AminesSecondaryHeteroNH
  • {KO} ReacBromides
  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Pyrroles

相关文献及参考

安全信息

Warnings IRRITANT
WGK Germany3
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
GHS Symbol

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 Donors
2
H-bond Acceptors
2
Rotatable Bonds
1
LogP
1

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

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