4-Bromobenzylidenemalononitrile 2-(4-溴亚苄基)丙二腈

CAS 2826-24-6 MFCD00176213

化学结构图

2826-24-6
SMILES: N#CC(C#N)=Cc1ccc(Br)cc1

化学属性

Mol. FormulaC10H5BrN2
Mol. Weight233.06
Melting Point160-162 °C

别名和识别编码

Chemical Name4-Bromobenzylidenemalononitrile
Alfabeta NameBROMOPHENYLMETHYLENEMALONONITRILE 24[]()--
MDL NumberMFCD00176213
CAS Number2826-24-6
Chemical Name Translation2-(4-溴亚苄基)丙二腈
LabNetwork Molecule IDLN00149149
PubChem Substance ID219340
InChIInChI=1S/C10H5BrN2/c11-10-3-1-8(2-4-10)5-9(6-12)7-13/h1-5H
Synonym 2-(4-Bromobenzylidene)malononitrile {LY} 2-(4-Bromobenzylidene)malononitrile {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Bromobenzylidene)malonon
Canonical SMILESN#C/C(C#N)=C/C1=CC=C(C=C1)Br
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分类

  • {KO} Nitriles
  • {KO} ReacBromides

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 Donors
0
H-bond Acceptors
2
Rotatable Bonds
2
LogP
2

系列性分类

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