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(4R,4'R)-2,2'-(1,3-Dihydro-2H-inden-2-ylidene)bis[4,5-dihydro-4-(phenylmethyl)oxazole]

  • CAS No. 2757082-00-9

  • Cat. No. CS-0103982
  • Purity≥95%
  • MDL No.MFCD34563573

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

(4R,4'R)-2,2'-(1,3-Dihydro-2H-inden-2-ylidene)bis[4,5-dihydro-4-(phenylmethyl)oxazole]|CS-0103982

Structure of 2757082-00-9

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General Information

  • CAS No. 2757082-00-9
  • Cat. No. CS-0103982
  • Purity ≥95%
  • MDL No. MFCD34563573
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₉H₂₈N₂O₂
  • Molecular Weight 436.54
  • Synonym(s) None
  • SMILES C1(CC(C2=N[C@H](CC3=CC=CC=C3)CO2)(C4=N[C@H](CC5=CC=CC=C5)CO4)C6)=C6C=CC=C1

Description

This chiral bisoxazole scaffold features a rigid, electron-rich indenyl bridge that enhances structural stability and facilitates precise spatial orientation. The phenylmethyl substituents improve solubility and compatibility in synthetic transformations. This configuration enables efficient integration into asymmetric catalysis and molecular recognition systems under standard conditions.

Application

(4R,4'R)-2,2'-(1,3-Dihydro-2H-inden-2-ylidene)bis[4,5-dihydro-4-(phenylmethyl)oxazole] serves as a chiral bis-oxazole scaffold with defined stereochemistry at the indenylidene linkage. Its rigid, C₂-symmetric structure enables precise spatial control in asymmetric synthesis, particularly in ligand design for transition metal catalysis. The benzyl-substituted oxazole rings exhibit enhanced stability and solubility, facilitating purification and handling. This compound functions effectively as a modular building block for complex heterocyclic systems and advanced catalyst frameworks in synthetic organic chemistry.

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   4.8516
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   6

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