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CS-W001157 4
Total: USD 88.00

5,5-Dimethylhexan-2-one

  • CAS No. 14272-73-2

  • Cat. No. CS-0446419
  • Molecule weight128.21
  • Purity≥98%
  • MDL No.None

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

5,5-Dimethylhexan-2-one|CS-0446419

Structure of 14272-73-2

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General Information

  • CAS No. 14272-73-2
  • Cat. No. CS-0446419
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₆O
  • Molecular Weight 128.21
  • Synonym(s) 5,5-Dimethyl-2-hexanone
  • SMILES CC(CCC(C)(C)C)=O

Synthesis

  • Route1
    • null|null
      201230-82-2
    • null|null
      78-94-4
    • ~13%
    • null|null
      38453-95-1
    • 5,5-Dimethylhexan-2-one|CS-0446419
      14272-73-2

    References

    • Seyfert, Dietmar; Hui, Richard C. Journal of the American Chemical Society, 1985 , vol. 107, # 15 p. 4551 - 4553
  • Route2
    • null|null
      38442-51-2
    • null|null
      78-94-4
    • ~83%
    • 5,5-Dimethylhexan-2-one|CS-0446419
      14272-73-2

    References

    • Russell, Glen A.; Baik, Woonphil; Ngoviwatchai, Preecha; Kim, Byeong Hyo Acta Chemica Scandinavica, 1990 , vol. 44, # 2 p. 170 - 177
  • Route3
    • null|null
      594-19-4
    • null|null
      78-94-4
    • ~91%
    • 5,5-Dimethylhexan-2-one|CS-0446419
      14272-73-2

    References

    • Zinn, Fabiano K.; Ramos, Eduardo C.; Comasseto, Joao V. Tetrahedron Letters, 2001 , vol. 42, # 13 p. 2415 - 2417

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Danger
UN#: 1224
Class : 3
Packing Group : Ⅲ
Hazard Statements : H225-H315-H319
Precautionary Statements : P210-P233-P240-P241-P242-P243-P264-P280-P302+P352-P362+P364-P370+P378-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.4017
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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