5-Bromo-2-Methylbenzodoxazole 5-溴-2-甲基苯并恶唑

CAS 5676-56-2 MFCD08702771

化学结构图

5676-56-2
SMILES: Cc1nc2cc(Br)ccc2o1

化学属性

Mol. FormulaC8H6BrNO
Mol. Weight212.04
Melting Point61-65°C
Boiling Point264.8±13.0 °C at 760 mmHg

别名和识别编码

Chemical Name5-Bromo-2-Methylbenzodoxazole
CAS Number5676-56-2
Alfabeta NameBROMOMETHYLBENZOXAZOLE 5213-----,
MDL NumberMFCD08702771
Chemical Name Translation5-溴-2-甲基苯并恶唑
Synonym 5-Bromo-2-methyl-1,3-benzoxazole {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Bromo-2-methyl-1,3-benzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Bromo-2
LabNetwork Molecule IDLN00150962
PubChem Substance ID10104599
InChIInChI=1S/C8H6BrNO/c1-5-10-7-4-6(9)2-3-8(7)11-5/h2-4H,1H3
Canonical SMILESCC1=NC2=CC(Br)=CC=C2O1
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分类

  • Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, New Products for Chemical Synthesis, Oxazoles
  • {KO} ReacBromides

相关文献及参考

安全信息

Warnings IRRITANT
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
0
H-bond Donors
0
LogP
2

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. Halogenated Heterocycles 卤代杂环
  5. Oxazoles - Halogenated Heterocycles
  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. Benzoxazole 苯并恶唑

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