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499757 Sigma-Aldrich

Phenoxyacetonitrile

98%

  • CAS Number 3598-14-9

  • Linear Formula C6H5OCH2CN

  • Molecular Weight 133.15

  •  MDL number MFCD00052017

  •  PubChem Substance ID 24873297

  •  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 1.524 (lit.)
bp   235-238 °C (lit.)
density   1.09 g/mL at 25 °C (lit.)
SMILES string   N#CCOc1ccccc1
InChI   1S/C8H7NO/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,7H2
InChI key   VLLSCJFPVSQXDM-UHFFFAOYSA-N

Description

Application

Phenoxyacetonitrile may be used in the synthesis of:
• 2,4-dihydroxyphenoxyacetophenones
• methylthio(phenoxy)acetonitrile
• 2,4-diamino-5-(3,4,5-trimethoxyphenoxy)pyrimidine

Packaging

5 mL in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

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

References

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