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125954 Sigma-Aldrich

Dichloroacetonitrile

98%

  • CAS Number 3018-12-0

  • Linear Formula Cl2CHCN

  • Molecular Weight 109.94

  •  Beilstein/REAXYS Number 1739029

  •  EC Number 221-159-4

  •  MDL number MFCD00040886

  •  PubChem Substance ID 24847689

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C1 to C5, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds - Organic Building Blocks,
Quality Level   100
assay   98%
refractive index   n20/D 1.44 (lit.)
bp   110-112 °C (lit.)
density   1.369 g/mL at 25 °C (lit.)
SMILES string   ClC(Cl)C#N
InChI   1S/C2HCl2N/c3-2(4)1-5/h2H
InChI key   STZZWJCGRKXEFF-UHFFFAOYSA-N

Description

Application

Dichloroacetonitrile was used to develop an efficient method for the extraction and determination of common volatile halogenated disinfection by-products using the static headspace technique coupled with gas chromatography-mass spectrometry.

Packaging

25 g in glass bottle

Biochem/physiol Actions

Dichloroacetonitrile is direct-acting mutagen and induces DNA strand breaks in cultured human lymphoblastic cells. It induces apoptosis or necrosis in murine macrophage cell line via reactive oxygen intermediates-mediated oxidative mechanisms of cellular damage.

Safety & Documentation

Safety Information

Symbol 
Signal word 
Danger
Hazard statements 
Precautionary statements 
RIDADR 
UN 2920 3(8) / PGII
WGK Germany 
WGK 3
RTECS 
AL8465000
Flash Point(F) 
96.8 °F - closed cup
Flash Point(C) 
36 °C - closed cup
Protocols & Articles
Peer-Reviewed Papers
15

References

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