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CS-W001157 4
Total: USD 88.00

4-Oxoadamantan-1-yl acetate

  • CAS No. 63382-10-5

  • Cat. No. CS-0574649
  • Molecule weight208.25
  • Purity≥98%
  • MDL No.None

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

4-Oxoadamantan-1-yl acetate|CS-0574649

Structure of 63382-10-5

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General Information

  • CAS No. 63382-10-5
  • Cat. No. CS-0574649
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₃
  • Molecular Weight 208.25
  • Synonym(s) 4-OXO-1-ADAMANTYL ACETATE
  • SMILES CC(=O)OC12CC3CC(C1)C(=O)C(C3)C2

Synthesis

  • Route1

    References

    • Rohde, Jeffrey J.; Pliushchev, Marina A.; Sorensen, Bryan K.; Wodka, Dariusz; Shuai, Qi; Wang, Jiahong; Fung, Steven; Monzon, Katina M.; Chiou, William J.; Pan, Liping; Deng, Xiaoqing; Chovan, Linda E.; Ramaiya, Atul; Mullally, Mark; Henry, Rodger F.; Stolarik, DeAnne F.; Imade, Hovis M.; Marsh, Kennan C.; Beno, David W. A.; Fey, Thomas A.; Droz, Brian A.; Brune, Michael E.; Camp, Heidi S.; Sham, Hing L.; Frevert, Ernst Uli; Jacobson, Peer B.; Link Journal of Medicinal Chemistry, 2007 , vol. 50, # 1 p. 149 - 164
  • Route2

    References

    • Bobek, Michael M.; Brinker, Udo H. Synthetic Communications, 1999 , vol. 29, # 18 p. 3221 - 3225

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   1.6973
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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