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CS-W001157 4
Total: USD 88.00

4-(2-propyn-1-lyoxy)-Benzonitrile

  • CAS No. 33143-80-5

  • Cat. No. CS-0009027
  • Purity≥98%
  • MDL No.None

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

4-(2-propyn-1-lyoxy)-Benzonitrile|CS-0009027

Structure of 33143-80-5

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General Information

  • CAS No. 33143-80-5
  • Cat. No. CS-0009027
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇NO
  • Molecular Weight 157.17
  • Synonym(s) 4-(Prop-2-yn-1-yloxy)benzonitrile
  • SMILES C#CCOC1=CC=C(C#N)C=C1

Synthesis

  • Route1
    • 4-Cyanophenol Febuxostat Impurity|CS-0213981
      767-00-0
    • null|null
      106-96-7
    • ~86%
    • 4-(2-propyn-1-lyoxy)-Benzonitrile|CS-0009027
      33143-80-5

    References

    • Okuno, Tsunehisa; Yamane, Kentaro; Sandman, Daniel J. Molecular Crystals and Liquid Crystals, 2006 , vol. 456, # 1 p. 45 - 53
  • Route2
    • null|null
      1079882-90-8
    • ~78%
    • 4-(2-propyn-1-lyoxy)-Benzonitrile|CS-0009027
      33143-80-5

    References

    • Lamani, Manjunath; Devadig, Pradeep; Prabhu, Kandikere Ramaiah Organic and Biomolecular Chemistry, 2012 , vol. 10, # 14 p. 2753 - 2759
  • Route3

    References

    • Rokade, Balaji V.; Prabhu, Kandikere Ramaiah Journal of Organic Chemistry, 2012 , vol. 77, # 12 p. 5364 - 5370

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   1.57028
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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