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209392 Sigma-Aldrich

3-Methoxyphenylacetonitrile

99%

Synonym: 3-Methoxybenzyl cyanide

  • CAS Number 19924-43-7

  • Linear Formula CH3OC6H4CH2CN

  • Molecular Weight 147.17

  •  Beilstein/REAXYS Number 1865539

  •  EC Number 243-428-5

  •  MDL number MFCD00001910

  •  PubChem Substance ID 24852567

  •  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   99%
refractive index   n20/D 1.532 (lit.)
bp   164-165 °C/20 mmHg (lit.)
density   1.054 g/mL at 25 °C (lit.)
SMILES string   COc1cccc(CC#N)c1
InChI   1S/C9H9NO/c1-11-9-4-2-3-8(7-9)5-6-10/h2-4,7H,5H2,1H3
InChI key   LXKNAUOWEJWGTE-UHFFFAOYSA-N

Description

Application

3-Methoxyphenylacetonitrile was used in the synthesis of:
• new immunogen for homovanillic acid
• β,β′-cyclobisalkylated melatoninergic phenylalkylamides
• α-sec-butyl-3-methoxy phenylacetonitrile, antispasmodic agent

Packaging

5, 25 g in glass bottle

Safety & Documentation

Safety Information

RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
208.4 °F - closed cup
Flash Point(C) 
98 °C - closed cup

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

References

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