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CS-W001157 4
Total: USD 88.00

4-((2-Methylbut-3-yn-2-yl)oxy)benzonitrile

  • CAS No. 33143-92-9

  • Cat. No. CS-0314106
  • Molecule weight185.22
  • Purity≥98%
  • MDL No.MFCD00174270

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

4-((2-Methylbut-3-yn-2-yl)oxy)benzonitrile|CS-0314106

Structure of 33143-92-9

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General Information

  • CAS No. 33143-92-9
  • Cat. No. CS-0314106
  • Purity ≥98%
  • MDL No. MFCD00174270
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁NO
  • Molecular Weight 185.22
  • Synonym(s) 4-[(1,1-Dimethylprop-2-ynyl)oxy]benzonitrile
  • SMILES C#CC(C)(C)OC1=CC=C(C=C1)C#N

Synthesis

  • Route1
    • null|null
      1111-97-3
    • 4-Cyanophenol Febuxostat Impurity|CS-0213981
      767-00-0
    • ~96%
    • In-stock
      4-((2-Methylbut-3-yn-2-yl)oxy)benzonitrile|CS-0314106
      33143-92-9

    References

    • Bell; Davies; Geen; Mann Synthesis, 1995 , # 6 p. 707 - 712
  • Route2
    • null|null
      19021-53-5
    • 4-Cyanophenol Febuxostat Impurity|CS-0213981
      767-00-0
    • ~86%
    • In-stock
      4-((2-Methylbut-3-yn-2-yl)oxy)benzonitrile|CS-0314106
      33143-92-9

    References

    • Godfrey, Jollie D.; Mueller, Richard H.; Sedergran, Thomas C.; Soundarajan, Nachimuthu; Colandrea, Vincent J. Tetrahedron Letters, 1994 , vol. 35, # 35 p. 6405 - 6408
  • Route3
    • 4-Cyanophenol Febuxostat Impurity|CS-0213981
      767-00-0
    • ~%
    • In-stock
      4-((2-Methylbut-3-yn-2-yl)oxy)benzonitrile|CS-0314106
      33143-92-9

    References

    • US5463059 A1, ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   2.34888
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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