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(3aS,3'aS,8aR,8'aR)-2,2'-Cyclohexylidenebis[3a,8a-dihydro-dihydro-8H-indeno[1,2-d]oxazole

  • CAS No. 2341858-19-1

  • Cat. No. CS-0104029
  • Purity≥97%
  • MDL No.None

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

(3aS,3'aS,8aR,8'aR)-2,2'-Cyclohexylidenebis[3a,8a-dihydro-dihydro-8H-indeno[1,2-d]oxazole|CS-0104029

Structure of 2341858-19-1

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General Information

  • CAS No. 2341858-19-1
  • Cat. No. CS-0104029
  • Purity ≥97%
  • MDL No. None
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₇H₂₈N₂O₂
  • Molecular Weight 412.52
  • Synonym(s) (3aS,3a'S,8aR,8a'R)-2,2'-(cycloheptane-1,1-diyl)bis(3a,8a-dihydro-8H-indeno[1,2-d]oxazole)
  • SMILES [C@H]12OC(C3(CCCCCC3)C4=N[C@@H](C(C=CC=C5)=C5C6)[C@@H]6O4)=N[C@H]1C7=C(C=CC=C7)C2

Description

This bicyclic oxazole scaffold features a rigid, chiral cyclohexylidene bridge that enforces defined spatial orientation. The fused indeno-oxazole framework delivers enhanced thermal stability and predictable stereochemical behavior. This structural rigidity enables precise molecular recognition in asymmetric synthesis and catalytic applications.

Application

(3aS,3'aS,8aR,8'aR)-2,2'-Cyclohexylidenebis[3a,8a-dihydro-dihydro-8H-indeno[1,2-d]oxazole] serves as a rigid, chiral bis-oxazole scaffold with defined stereochemistry, enabling precise spatial control in asymmetric synthesis. Its stability and functional group tolerance facilitate use in ligand design and heterocyclic core construction. The cyclohexylidene bridge enhances conformational rigidity, supporting its utility in catalyst development and medicinal chemistry scaffolds requiring defined three-dimensional architecture.

Safety Information

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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   43.18
  • LogP   5.5164
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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