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CS-W001157 4
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1-(3-Methylbicyclo[1.1.1]pentan-1-yl)ethan-1-one

  • CAS No. 83249-16-5

  • Cat. No. CS-0102905
  • Purity≥98%
  • MDL No.None

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

1-(3-Methylbicyclo[1.1.1]pentan-1-yl)ethan-1-one|CS-0102905

Structure of 83249-16-5

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General Information

  • CAS No. 83249-16-5
  • Cat. No. CS-0102905
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₂O
  • Molecular Weight 124.18
  • Synonym(s) Ethanone, 1-(3-methylbicyclo[1.1.1]pent-1-yl)- (9CI)
  • SMILES CC(C1(C2)CC2(C)C1)=O

Synthesis

  • Route1

    References

    • Applequist, Douglas E.; Renken, Terry L.; Wheeler, James W. Journal of Organic Chemistry, 1982 , vol. 47, # 25 p. 4985 - 4995
  • Route2
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      30494-14-5
    • ~%
    • 1-(3-Methylbicyclo[1.1.1]pentan-1-yl)ethan-1-one|CS-0102905
      83249-16-5

    References

    • Applequist, Douglas E.; Renken, Terry L.; Wheeler, James W. Journal of Organic Chemistry, 1982 , vol. 47, # 25 p. 4985 - 4995
  • Route3
    • Methyl 3-methylbicyclo[1.1.0]Butane-1-carboxylate|CS-0450756
      30493-92-6
    • ~%
    • 1-(3-Methylbicyclo[1.1.1]pentan-1-yl)ethan-1-one|CS-0102905
      83249-16-5

    References

    • Applequist, Douglas E.; Renken, Terry L.; Wheeler, James W. Journal of Organic Chemistry, 1982 , vol. 47, # 25 p. 4985 - 4995

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
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   17.07
  • LogP   1.7656
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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