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CS-W001157 4
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1-Bromo-3-methyladamantane

  • CAS No. 702-77-2

  • Cat. No. CS-0119864
  • Molecule weight229.16
  • Purity≥97%
  • MDL No.MFCD00167799

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

1-Bromo-3-methyladamantane|CS-0119864

Structure of 702-77-2

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General Information

  • CAS No. 702-77-2
  • Cat. No. CS-0119864
  • Purity ≥97%
  • MDL No. MFCD00167799
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₇Br
  • Molecular Weight 229.16
  • Synonym(s) 1-bromo-3-methyltricyclo[3.3.1.1~3,7~]decane
  • SMILES Br[C@](C[C@H](C1)C2)(C[C@@H]1C3)C[C@]23C

Synthesis

  • Route1
    • 3-Methyladamantan-1-ol|CS-1138847
      702-81-8
    • ~85%
    • In-stock
      1-Bromo-3-methyladamantane|CS-0119864
      702-77-2

    References

    • Henkel, James G.; Hane, Jeffrey T.; Gianutsos, Gerald Journal of Medicinal Chemistry, 1982 , vol. 25, # 1 p. 51 - 56
  • Route2

    References

    • JUSTUS-LIEBIG-UNIVERSITAeT GIESSEN Patent: WO2006/10362 A1, 2006 ; Location in patent: Page/Page column 54-55 ;
  • Route3

    References

    • Canadian Journal of Chemistry, , vol. 65, p. 2428 - 2433

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
Precautionary Statements : P261-P280-P304+P340

Quality Control

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.7402
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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