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191167 Sigma-Aldrich

3-Nitrobenzyl chloride

97%

Synonym: α-Chloro-3-nitrotoluene

  • CAS Number 619-23-8

  • Linear Formula O2NC6H4CH2Cl

  • Molecular Weight 171.58

  •  Beilstein/REAXYS Number 742794

  •  EC Number 210-586-1

  •  MDL number MFCD00007272

  •  PubChem Substance ID 24851471

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, Chemical Synthesis, Nitro Compounds, Nitrogen Compounds - Organic Building Blocks, Organic Building Blocks More...
assay   97%
bp   85-87 °C/5 mmHg (lit.)
mp   43-47 °C (lit.)
SMILES string   [O-][N+](=O)c1cccc(CCl)c1
InChI   1S/C7H6ClNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2
InChI key   APGGSERFJKEWFG-UHFFFAOYSA-N

Description

General description

Influence of solvent on reduction mechanism of 3-nitrobenzyl chloride was investigated by cyclic voltammetry and controlled potential bulk electrolysis.

Application

3-Nitrobenzyl chloride was used in the synthesis of 8-chloropurine.

Packaging

10, 50 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS05  GHS05
Signal word 
Danger
Hazard statements 
Precautionary statements 
RIDADR 
UN 3261 8 / PGII
WGK Germany 
WGK 3
Flash Point(F) 
230.0 °F - closed cup
Flash Point(C) 
110 °C - closed cup

Documents

Certificate of Analysis (COA)

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Certificate of Origin (COO)

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

References

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