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113360 Sigma-Aldrich

3,4,5-Trimethoxyphenylacetonitrile

97%

Synonym: 3,4,5-Trimethoxybenzyl cyanide

  • CAS Number 13338-63-1

  • Linear Formula (CH3O)3C6H2CH2CN

  • Molecular Weight 207.23

  •  Beilstein/REAXYS Number 2214548

  •  EC Number 236-388-5

  •  MDL number MFCD00001912

  •  PubChem Substance ID 24846877

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C10 to C27, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds - Organic Building Blocks,
assay   97%
mp   77-79 °C (lit.)
storage temp.   room temp
SMILES string   COc1cc(CC#N)cc(OC)c1OC
InChI   1S/C11H13NO3/c1-13-9-6-8(4-5-12)7-10(14-2)11(9)15-3/h6-7H,4H2,1-3H3
InChI key   ACFJNTXCEQCDBX-UHFFFAOYSA-N

Description

General description

3,4,5-Trimethoxyphenylacetonitrile is synthesized by the condensation of 3 : 4 : 5-trimethoxybenzaldehyde with hippuric acid.

Application

3,4,5-Trimethoxyphenylacetonitrile is used as an internal standard during the determination of vancomycin in serum. The method used involved a direct and rapid solvent precipitation of protein.

Packaging

10 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable
Protocols & Articles
Peer-Reviewed Papers
15

References

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