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6-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-one

  • CAS No. 67159-84-6

  • Cat. No. CS-0311682
  • Molecule weightNone
  • Purity≥98%
  • MDL No.MFCD17267475

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

6-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-one|CS-0311682

Structure of 67159-84-6

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General Information

  • CAS No. 67159-84-6
  • Cat. No. CS-0311682
  • Purity ≥98%
  • MDL No. MFCD17267475
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁BrO
  • Molecular Weight None
  • Synonym(s) 6-Bromo-3,3-dimethyl-indan-1-one
  • SMILES O=C1CC(C)(C)C2=C1C=C(Br)C=C2

Synthesis

  • Route1

    References

    • Bristol-Myers Squibb Co. Patent: US5648385 A1, 1997 ;
  • Route2
    • 3,3-Dimethyl-6-nitro-2,3-dihydro-1H-inden-1-one|CS-0968443
      67159-79-9
    • ~%
    • In-stock
      6-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-one|CS-0311682
      67159-84-6

    References

    • Atwal, Karnail S.; Ferrara, Francis N.; Ding, Charles Z.; Grover, Gary J.; Sleph, Paul G.; Dzwonczyk, Steven; Baird, Anne J.; Normandin, Diane E. Journal of Medicinal Chemistry, 1996 , vol. 39, # 1 p. 304 - 313

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-H312-H315-H319-H335
Precautionary Statements : P260-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P337+P313-P362+P364-P363-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.3131
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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