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527696 Sigma-Aldrich

2,4-Dinitrobenzonitrile

97%

  • CAS Number 4110-33-2

  • Linear Formula (O2N)2C6H3CN

  • Molecular Weight 194.12

  •  MDL number MFCD00465665

  •  PubChem Substance ID 24874638

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C6 to C7, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds - Organic Building Blocks,
Quality Level   100
assay   97%
mp   100-103 °C (lit.)
SMILES string   [O-][N+](=O)c1ccc(C#N)c(c1)[N+]([O-])=O
InChI   1S/C7H3N3O4/c8-4-5-1-2-6(9(11)12)3-7(5)10(13)14/h1-3H
InChI key   KCUDEOWPXBMDJE-UHFFFAOYSA-N

Description

General description

2,4-Dinitrobenzonitrile is formed as one of the reaction products from the elimination reactions of (E)-2,4-dinitrobenzaldehyde O-aryloximes. (E)-2,4-Dinitrobenzonitrile is obtained from the reaction between (E)-2,4-dinitrobenzaldehyde O-benzoyloxime with i-Pr2NH in methylcyanide.

Application

2,4-Dinitrobenzonitrile may be used to synthesize N′-hydroxy-2,4-dinitrobenzimidamide.

Packaging

1, 5 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
Signal word 
Danger
Hazard statements 
RIDADR 
UN1325 - class 4.1 - PG 2 - Flammable solids, organic, n.o.s., HI: all
WGK Germany 
WGK 3
Flash Point(F) 
55.0 °F - closed cup
Flash Point(C) 
12.78 °C - closed cup

Documents

Certificate of Analysis (COA)

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Meet Synthia - Retrosynthesis Sofware
Protocols & Articles
Peer-Reviewed Papers
15

References

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