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89660 Sigma-Aldrich

o-Tolunitrile

≥97.0% (GC)

Synonym: 2-Methylbenzonitrile

  • CAS Number 529-19-1

  • Linear Formula CH3C6H4CN

  • Molecular Weight 117.15

  •  Beilstein/REAXYS Number 1857417

  •  EC Number 208-451-7

  •  MDL number MFCD00001792

  •  PubChem Substance ID 24889248

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C8 to C9, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds - Organic Building Blocks,
Quality Level   100
assay   ≥97.0% (GC)
refractive index   n20/D 1.5279 (lit.)
  n20/D 1.528
bp   205 °C (lit.)
mp   −13-−11 °C (lit.)
  −13-−11 °C
density   0.989 g/mL at 25 °C (lit.)
SMILES string   Cc1ccccc1C#N
InChI   1S/C8H7N/c1-7-4-2-3-5-8(7)6-9/h2-5H,1H3
InChI key   NWPNXBQSRGKSJB-UHFFFAOYSA-N

Description

Packaging

250 mL in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
WGK Germany 
WGK 2
RTECS 
XV0600000
Flash Point(F) 
179.6 °F - closed cup
Flash Point(C) 
82 °C - closed cup

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Protocols & Articles
Peer-Reviewed Papers
15

References

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