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

  • CAS No. 2097145-90-7

  • Cat. No. CS-0104005
  • Purity≥97%
  • MDL No.None

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

(3aR,3'aR,8aS,8'aS)-2,2'-Cyclobutylidenebis[3a,8a-dihydro-8H-indeno[1,2-d]oxazole]|CS-0104005

Structure of 2097145-90-7

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General Information

  • CAS No. 2097145-90-7
  • Cat. No. CS-0104005
  • Purity ≥97%
  • MDL No. None
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₄H₂₂N₂O₂
  • Molecular Weight 370.44
  • Synonym(s) (3aR,3a'R,8aS,8a'S)-2,2'-(Cyclobutane-1,1-diyl)bis(3a,8a-dihydro-8H-indeno[1,2-d]oxazole)
  • SMILES [C@@H]12OC(C3(CCC3)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, sterically defined core with dual indeno-oxazole units linked by a cyclobutylidene bridge. The configuration at the chiral centers imparts high structural integrity and predictable stereochemical behavior. Designed for use in asymmetric synthesis and molecular recognition applications, it offers enhanced stability under standard bench conditions and facilitates precise spatial control in catalytic or ligand systems.

Application

(3aR,3'aR,8aS,8'aS)-2,2'-Cyclobutylidenebis[3a,8a-dihydro-8H-indeno[1,2-d]oxazole] serves as a rigid, chiral bis-heterocyclic scaffold enabling precise spatial control in asymmetric synthesis. Its fused indeno-oxazole framework exhibits excellent bench stability and functional group tolerance, facilitating use in transition-metal-catalyzed coupling reactions and as a building block for complex polycyclic systems. The molecule functions effectively as a ligand precursor or auxiliary in stereoselective transformations.

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   43.18
  • LogP   4.3461
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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