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M31651 Sigma-Aldrich

4-Methylbenzyl cyanide

98%

Synonym: α-Cyano-p-xylene, 4-Methylphenylacetonitrile, 4-Methylbenzyl cyanide, p-Tolylacetonitrile

  • CAS Number 2947-61-7

  • Linear Formula CH3C6H4CH2CN

  • Molecular Weight 131.17

  •  Beilstein/REAXYS Number 1099645

  •  EC Number 220-963-2

  •  MDL number MFCD00001922

  •  PubChem Substance ID 24896806

  •  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   98%
refractive index   n20/D 1.519 (lit.)
bp   242-243 °C (lit.)
mp   18 °C (lit.)
density   0.992 g/mL at 25 °C (lit.)
SMILES string   Cc1ccc(CC#N)cc1
InChI   1S/C9H9N/c1-8-2-4-9(5-3-8)6-7-10/h2-5H,6H2,1H3
InChI key   RNHKXHKUKJXLAU-UHFFFAOYSA-N

Description

Packaging

25 g in glass bottle

Safety & Documentation

Safety Information

Hazard statements 
Precautionary statements 
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
222.8 °F - closed cup
Flash Point(C) 
106 °C - closed cup

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