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CS-W001157 4
Total: USD 88.00

6,6-Dimethylcyclohex-2-en-1-one

  • CAS No. 6553-64-6

  • Cat. No. CS-0242735
  • Purity≥95%
  • MDL No.None

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

6,6-Dimethylcyclohex-2-en-1-one|CS-0242735

Structure of 6553-64-6

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General Information

  • CAS No. 6553-64-6
  • Cat. No. CS-0242735
  • Purity ≥95%
  • 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) 6,6-Dimethylcyclohex-2-enone
  • SMILES O=C1C=CCCC1(C)C

Synthesis

  • Route1
    • null|null
      201230-82-2
    • null|null
      4181-07-1
    • ~50%
    • 6,6-Dimethylcyclohex-2-en-1-one|CS-0242735
      6553-64-6

    References

    • Keraenen, Mark D.; Kot, Kinga; Hollmann, Christoph; Eilbracht, Peter Organic and Biomolecular Chemistry, 2004 , vol. 2, # 22 p. 3379 - 3384
  • Route2
    • null|null
      62952-32-3
    • ~98%
    • 6,6-Dimethylcyclohex-2-en-1-one|CS-0242735
      6553-64-6

    References

    • Winska, Katarzyna; Grudniewska, Aleksandra; Chojnacka, Anna; Bialonska, Agata; Wawrzenczyk, Czeslaw Tetrahedron Asymmetry, 2010 , vol. 21, # 6 p. 670 - 678
  • Route3
    • 6-Bromo-2,2-dimethylcyclohexan-1-one|CS-1373790
      21690-26-6
    • ~71%
    • 6,6-Dimethylcyclohex-2-en-1-one|CS-0242735
      6553-64-6

    References

    • Edwards, Oliver E.; Dixon, John; Elder, John W.; Kolt, Ralph J.; Lesage, Maurice Canadian Journal of Chemistry, 1981 , vol. 59, p. 2096 - 2115

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   1.9317
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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