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CS-W001157 4
Total: USD 88.00

2-(2-Methoxyphenoxy)acetonitrile

  • CAS No. 6781-29-9

  • Cat. No. CS-0317334
  • Molecule weight163.17
  • Purity95+%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2-(2-Methoxyphenoxy)acetonitrile|CS-0317334

Structure of 6781-29-9

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General Information

  • CAS No. 6781-29-9
  • Cat. No. CS-0317334
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₂
  • Molecular Weight 163.17
  • Synonym(s) (2-Methoxyphenoxy)acetonitrile
  • SMILES COC1=CC=CC=C1OCC#N

Synthesis

  • Route1
    • Guaiacol Guaifenesin Impurity|CS-0229801
      90-05-1
    • null|null
      590-17-0
    • ~77%
    • 2-(2-Methoxyphenoxy)acetonitrile|CS-0317334
      6781-29-9

    References

    • Eli Lilly and Company Patent: US6140352 A1, 2000 ; US 6140352 A
  • Route2
    • null|null
      107-14-2
    • Guaiacol Guaifenesin Impurity|CS-0229801
      90-05-1
    • ~%
    • 2-(2-Methoxyphenoxy)acetonitrile|CS-0317334
      6781-29-9

    References

    • DE684945 , ; DRP/DRBP Org.Chem. US2149457 , ; CH204734 , ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   42.25
  • LogP   1.59758
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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