Malononitrile, (3,4,5-trimethoxybenzylidene)- 2-(3,4,5-三甲氧基亚苄基)丙二腈

CAS 5688-82-4 MFCD00126182

化学结构图

5688-82-4
SMILES: COc1cc(C=C(C#N)C#N)cc(OC)c1OC

化学属性

Mol. FormulaC13H12N2O3
Mol. Weight244.25

别名和识别编码

Chemical NameMalononitrile, (3,4,5-trimethoxybenzylidene)-
Chemicalbook IDCB4906470
Synonym 2-(3,4,5-Trimethoxybenzylidene)malononitrile {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(3,4,5-Trimethoxybenzylidene)malononitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(3,4
Wiswesser Line NotationNCYCN&U1R CO1 DO1 EO1
Beilstein Registry Number2218615
CAS Number5688-82-4
InChIKeySHANJVNUXNVEJC-UHFFFAOYSA-N
LabNetwork Molecule IDLN00941843
Chemical Name Translation2-(3,4,5-三甲氧基亚苄基)丙二腈
PubChem Substance ID21888
InChIInChI=1S/C13H12N2O3/c1-16-11-5-9(4-10(7-14)8-15)6-12(17-2)13(11)18-3/h4-6H,1-3H3
Canonical SMILESCOC1=CC(=CC(=C1OC)OC)C=C(C#N)C#N
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安全信息

RTECSOO4490000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#07633

Storage condition

系列性分类

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