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

  • CAS No. 182122-13-0

  • Cat. No. CS-0087484
  • Purity≥97%
  • MDL No.None

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

(3aS,3a'S,8aR,8a'R)-2,2'-Cyclohexylidenebis[8,8a-dihydro-3aH-indeno[1,2-d]oxazole]|CS-0087484

Structure of 182122-13-0

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General Information

  • CAS No. 182122-13-0
  • Cat. No. CS-0087484
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₆H₂₆N₂O₂
  • Molecular Weight 398.50
  • Synonym(s) (3aS,3a'S,8aR,8a'R)-2,2'-Cyclohexylidenebis[8,8a-dihydro-3aH-indeno[1,2-d]oxazole],99e.e.
  • SMILES C1(C2(CCCCC2)C3=N[C@@H](C(C=CC=C4)=C4C5)[C@@H]5O3)=N[C@@H]6[C@@H](CC7=C6C=CC=C7)O1

Description

This chiral bis-oxazole scaffold delivers structural rigidity and defined stereochemistry for asymmetric synthesis applications. Featuring a cyclohexylidene bridge flanked by indeno[1,2-d]oxazole units, the molecule exhibits enhanced stability and predictable conformational behavior under standard conditions. Ideal for ligand design and catalyst development in enantioselective transformations.

Application

(3aS,3a'S,8aR,8a'R)-2,2'-Cyclohexylidenebis[8,8a-dihydro-3aH-indeno[1,2-d]oxazole] serves as a rigid, chiral bis-heterocyclic scaffold with defined stereochemistry, enabling precise spatial control in asymmetric synthesis. Its stable indeno[1,2-d]oxazole core exhibits excellent bench stability and tolerance to standard functional group manipulations. The cyclohexylidene bridge enhances conformational rigidity, facilitating its use in the development of stereoselective ligands and catalysts for transition-metal-catalyzed 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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   43.18
  • LogP   5.1263
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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