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Benzyl (2S,3aS,6aS)-octahydrocyclopenta[b]pyrrole-2-carboxylate

  • CAS No. 93779-31-8

  • Cat. No. CS-0462121
  • Molecule weight245.32
  • Purity≥98%
  • MDL No.None

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

Benzyl (2S,3aS,6aS)-octahydrocyclopenta[b]pyrrole-2-carboxylate|CS-0462121

Structure of 93779-31-8

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General Information

  • CAS No. 93779-31-8
  • Cat. No. CS-0462121
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₉NO₂
  • Molecular Weight 245.32
  • Synonym(s) (2S,3aS,6aS)-Benzyl octahydrocyclopenta[b]pyrrole-2-carboxylate
  • SMILES C1=CC=C(C=C1)COC(=O)[C@@H]2C[C@@H]3CCC[C@@H]3N2

Synthesis

  • Route1

    References

    • WO2005/121084 A1, ; Page/Page column 4-6 ;
  • Route2
    • null|null
      135214-79-8
    • ~%
    • Benzyl (2S,3aS,6aS)-octahydrocyclopenta[b]pyrrole-2-carboxylate|CS-0462121
      93779-31-8

    References

    • US2007/232680 A1, ; Page/Page column 11 ;
  • Route3
    • Benzyl (2S,3aS,6aS)-octahydrocyclopenta[b]pyrrole-2-carboxylate|CS-0462121
      93779-31-8
    • ~%
    • Benzyl (2S,3aS,6aS)-octahydrocyclopenta[b]pyrrole-2-carboxylate|CS-0462121
      93779-31-8
    • null|null
      129101-19-5

    References

    • Synthetic Communications, , vol. 38, # 11 p. 1737 - 1744

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

Quality Control

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Computational Chemistry Data

  • TPSA   38.33
  • LogP   2.2604
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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