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CS-W001157 4
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1-Ethynyl-3,3,5-trimethylcyclohexan-1-ol

  • CAS No. 70487-02-4

  • Cat. No. CS-0353120
  • Purity≥95%
  • MDL No.None

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

1-Ethynyl-3,3,5-trimethylcyclohexan-1-ol|CS-0353120

Structure of 70487-02-4

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General Information

  • CAS No. 70487-02-4
  • Cat. No. CS-0353120
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₈O
  • Molecular Weight 166.26
  • Synonym(s) 1-Ethynyl-3,3,5-trimethylcyclohexanol
  • SMILES OC1(C#C)CC(C)(C)CC(C)C1

Synthesis

  • Route1
    • null|null
      1066-26-8
    • ~%
    • 1-Ethynyl-3,3,5-trimethylcyclohexan-1-ol|CS-0353120
      70487-02-4

    References

    • Papa et al. Journal of the American Chemical Society, 1954 , vol. 76, p. 4446,4449
  • Route2
    • 3,3,5-Trimethylcyclohexanone|CS-0070744
      873-94-9
    • null|null
      74-86-2
    • ~%
    • 1-Ethynyl-3,3,5-trimethylcyclohexan-1-ol|CS-0353120
      70487-02-4

    References

    • Union Carbide and Carbon Research Labor. Patent: US2163720 , 1937 ;

Safety Information

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GHS Pictogram : N/A
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Signal Word : N/A
UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.1969
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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