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CS-W001157 4
Total: USD 88.00

tert-Butyl 2-oxocyclopentane-1-carboxylate

  • CAS No. 84109-76-2

  • Cat. No. CS-0137475
  • Molecule weight184.23
  • Purity≥98%
  • MDL No.MFCD19301646

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

tert-Butyl 2-oxocyclopentane-1-carboxylate|CS-0137475

Structure of 84109-76-2

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General Information

  • CAS No. 84109-76-2
  • Cat. No. CS-0137475
  • Purity ≥98%
  • MDL No. MFCD19301646
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₆O₃
  • Molecular Weight 184.23
  • Synonym(s) Tert-butyl 2-oxo-cyclopentanecarboxylate
  • SMILES O=C(C1C(CCC1)=O)OC(C)(C)C

Synthesis

  • Route1
    • Di-tert-butyl adipate|CS-0154835
      20270-53-5
    • ~81%
    • In-stock
      tert-Butyl 2-oxocyclopentane-1-carboxylate|CS-0137475
      84109-76-2

    References

    • Bunnage, Mark E.; Davies, Stephen G.; Parkin, Richard M.; Roberts, Paul M.; Smith, Andrew D.; Withey, Jonathan M. Organic and Biomolecular Chemistry, 2004 , vol. 2, # 22 p. 3337 - 3354
  • Route2
    • Di-tert-butyl octanedioate|CS-0535256
      22173-24-6
    • ~56%
    • In-stock
      tert-Butyl 2-oxocyclopentane-1-carboxylate|CS-0137475
      84109-76-2

    References

    • Beauchard, Anne; Phillips, Victoria A.; Lloyd, Matthew D.; Threadgill, Michael D. Tetrahedron, 2009 , vol. 65, # 39 p. 8176 - 8184
  • Route3
    • In-stock
      1-Oxocyclopentane-2-carboxylic acid ethyl ester|CS-D1430
      611-10-9
    • null|null
      75-65-0
    • ~54%
    • In-stock
      tert-Butyl 2-oxocyclopentane-1-carboxylate|CS-0137475
      84109-76-2

    References

    • Bandgar, Babasaheb P.; Hashmi, Arshad M.; Pandit, Shivaji S. Journal of the Chinese Chemical Society, 2005 , vol. 52, # 6 p. 1101 - 1104

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

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