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CS-W001157 4
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5-Bromoadamantan-2-one

  • CAS No. 20098-20-8

  • Cat. No. CS-0449415
  • Purity≥97%
  • MDL No.MFCD01321097

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

5-Bromoadamantan-2-one|CS-0449415

Structure of 20098-20-8

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General Information

  • CAS No. 20098-20-8
  • Cat. No. CS-0449415
  • Purity ≥97%
  • MDL No. MFCD01321097
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃BrO
  • Molecular Weight 229.11
  • Synonym(s) 5-Bromo-2-adamantanone
  • SMILES C1C2CC3CC(C2)(CC1C3=O)Br

Description

5-Bromoadamantan-2-one features a sterically encumbered adamantane core with a bromine substituent at the 5-position and a ketone at C-2. This configuration imparts high thermal stability and facilitates selective functionalization in synthetic transformations. The molecule serves as a robust building block for medicinal chemistry and materials science applications requiring rigid, hydrophobic scaffolds.

Synthesis

  • Route1

    References

    • WO2006/74244 A2, ; Page/Page column 87 ;
  • Route2

    References

    • Organic Letters, , vol. 5, # 16 p. 2943 - 2946
  • Route3

    References

    • Tetrahedron, , vol. 24, p. 5369 - 5377

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.5291
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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