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CS-W001157 4
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But-3-yn-2-ylbenzene

  • CAS No. 4544-28-9

  • Cat. No. CS-B0615
  • Molecule weight130.19
  • Purity≥95%
  • MDL No.None

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

But-3-yn-2-ylbenzene|CS-B0615

Structure of 4544-28-9

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General Information

  • CAS No. 4544-28-9
  • Cat. No. CS-B0615
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀
  • Molecular Weight 130.19
  • Synonym(s) (1-Methyl-2-propyn-1-yl)benzene
  • SMILES C#CC(C)C1=CC=CC=C1

Synthesis

  • Route1

    References

    • Gilbert, John C.; Giamalva, David H.; Weerasooriya, Upali Journal of Organic Chemistry, 1983 , vol. 48, # 26 p. 5251 - 5256
  • Route2
    • null|null
      77295-70-6
    • ~%
    • But-3-yn-2-ylbenzene|CS-B0615
      4544-28-9

    References

    • Hijfte, Luc Van; Kolb, Michael; Witz, Pascale Tetrahedron Letters, 1989 , vol. 30, # 28 p. 3655 - 3656
  • Route3
    • null|null
      86738-26-3
    • ~84%
    • But-3-yn-2-ylbenzene|CS-B0615
      4544-28-9

    References

    • Caporusso, Anna Maria; Lardicci, Luciano Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1983 , # 5 p. 949 - 953

Safety Information

Download SDS
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

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Computational Chemistry Data

  • TPSA   0
  • LogP   2.4233
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   1

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