2-Bromo-1-(bromomethyl)-4-nitrobenzene 2-溴-1-溴甲基-4-硝基苯

CAS 940-05-6 MFCD11100213

化学结构图

940-05-6
SMILES: O=[N+]([O-])c1ccc(CBr)c(Br)c1

化学属性

Mol. FormulaC7H5Br2NO2
Mol. Weight294.93
Melting Point73-74°C
Boiling Point348°C at 760 mmHg

别名和识别编码

Chemical Name2-Bromo-1-(bromomethyl)-4-nitrobenzene
CAS Number940-05-6
Alfabeta NameBROMOBROMOMETHYLNITROBENZENE 214()-----
MDL NumberMFCD11100213
Chemical Name Translation2-溴-1-溴甲基-4-硝基苯
LabNetwork Molecule IDLN00150320
PubChem Substance ID14644718
InChIInChI=1S/C7H5Br2NO2/c8-4-5-1-2-6(10(11)12)3-7(5)9/h1-3H,4H2
Synonym 2-Bromo-1-(bromomethyl)-4-nitrobenzene {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(bromomethyl)-4-nitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-B
Canonical SMILESO=[N+](C1=CC=C(CBr)C(Br)=C1)[O-]
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分类

  • {KO} Nitros
  • {KO} ReacBromides

安全信息

Warnings IRRITANT
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

药物吸收、分布、代谢与排泄(ADME)

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

系列性分类

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