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CS-W001157 4
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3,3,4,4-Tetramethylcyclopentan-1-one

  • CAS No. 56077-22-6

  • Cat. No. CS-0510683
  • Molecule weight140.22
  • Purity≥98%
  • MDL No.MFCD24689384

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

3,3,4,4-Tetramethylcyclopentan-1-one|CS-0510683

Structure of 56077-22-6

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General Information

  • CAS No. 56077-22-6
  • Cat. No. CS-0510683
  • Purity ≥98%
  • MDL No. MFCD24689384
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆O
  • Molecular Weight 140.22
  • Synonym(s) 3,3,4,4-Tetramethyl-cyclopentanone
  • SMILES O=C1CC(C)(C)C(C)(C)C1

Synthesis

  • Route1
    • 3,5-Dibromo-2,6-dimethylhepta-2,5-dien-4-one|CS-0510735
      5682-79-1
    • ~40%
    • 3,3,4,4-Tetramethylcyclopentan-1-one|CS-0510683
      56077-22-6

    References

    • Pawlowski, Michal; Maurin, Jan K.; Leniewski, Andrzej; Wojtasiewicz, Krystyna; Czarnocki, Zbigniew Heterocycles, 2005 , vol. 65, # 1 p. 9 - 22
  • Route2

    References

    • Pawlowski, Michal; Maurin, Jan K.; Leniewski, Andrzej; Wojtasiewicz, Krystyna; Czarnocki, Zbigniew Heterocycles, 2005 , vol. 65, # 1 p. 9 - 22
  • Route3
    • null|null
      876475-12-6
    • ~%
    • 3,3,4,4-Tetramethylcyclopentan-1-one|CS-0510683
      56077-22-6
    • null|null
      111689-30-6

    References

    • Shoppee Journal of the Chemical Society, 1928 , p. 1667

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.4017
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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