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CS-W001157 4
Total: USD 88.00

2,6-Dimethylcyclohexan-1-one

  • CAS No. 2816-57-1

  • Cat. No. CS-0215006
  • Purity≥98%
  • MDL No.None

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

2,6-Dimethylcyclohexan-1-one|CS-0215006

Structure of 2816-57-1

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General Information

  • CAS No. 2816-57-1
  • Cat. No. CS-0215006
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O
  • Molecular Weight 126.20
  • Synonym(s) 2,6-Dimethylcyclohexanone, mixture of isomers
  • SMILES CC1CCCC(C)C1=O

Synthesis

  • Route1
    • 2,6-Dimethylcyclohexanol|CS-0206011
      5337-72-4
    • ~94%
    • 2,6-Dimethylcyclohexan-1-one|CS-0215006
      2816-57-1

    References

    • Hirano, Masao; Nagasawa, Sonoko; Morimoto, Takashi Bulletin of the Chemical Society of Japan, 1991 , vol. 64, # 9 p. 2857 - 2859
  • Route2
    • 2,6-Dimethylcyclohexanol|CS-0206011
      5337-72-4
    • null|null
      7722-84-1
    • ~90%
    • 2,6-Dimethylcyclohexan-1-one|CS-0215006
      2816-57-1

    References

    • Instituto Guido Donegani S.p.A.; Consiglio Nazionale Delle Ricerche Patent: US4754073 A1, 1988 ;
  • Route3
    • null|null
      119703-98-9
    • ~99%
    • 2,6-Dimethylcyclohexan-1-one|CS-0215006
      2816-57-1

    References

    • Paterson, Ian Tetrahedron, 1988 , vol. 44, # 13 p. 4207 - 4220

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02
Signal Word : Warning
UN#: 1224
Class : 3
Packing Group : Ⅲ
Hazard Statements : H226
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P370+P378-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.0116
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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