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CS-W001157 4
Total: USD 88.00

2-Methyl-4-(o-tolyl)but-3-yn-2-ol

  • CAS No. 40888-14-0

  • Cat. No. CS-0207925
  • Purity≥98%
  • MDL No.MFCD13195741

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

2-Methyl-4-(o-tolyl)but-3-yn-2-ol|CS-0207925

Structure of 40888-14-0

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General Information

  • CAS No. 40888-14-0
  • Cat. No. CS-0207925
  • Purity ≥98%
  • MDL No. MFCD13195741
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄O
  • Molecular Weight 174.24
  • Synonym(s) 2-Methyl-4-o-tolylbut-3-yn-2-ol
  • SMILES CC1=CC=CC=C1C#CC(C)(C)O

Synthesis

  • Route1
    • null|null
      95-46-5
    • null|null
      115-19-5
    • ~83%
    • 2-Methyl-4-(o-tolyl)but-3-yn-2-ol|CS-0207925
      40888-14-0

    References

    • Hundertmark, Thomas; Littke, Adam F.; Buchwald, Stephen L.; Fu, Gregory C. Organic Letters, 2000 , vol. 2, # 12 p. 1729 - 1731
  • Route2

    References

    • Mori, Hajime; Matsuo, Takafumi; Yoshioka, Yasunori; Katsumura, Shigeo Journal of Organic Chemistry, 2006 , vol. 71, # 24 p. 9004 - 9012
  • Route3
    • null|null
      29552-15-6
    • null|null
      95-46-5
    • ~%
    • 2-Methyl-4-(o-tolyl)but-3-yn-2-ol|CS-0207925
      40888-14-0

    References

    • Shchelkunov; Sivolobova; Mataeva; Minbaev; Muldakhmetov Russian Journal of Organic Chemistry, 2001 , vol. 37, # 1 p. 5 - 8

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   20.23
  • LogP   2.11742
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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