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(4S,​4'S)​-2,​2'-​Cyclohexylidenebis[4​,​5-​dihydro-​4-​(phenylmethyl)​oxazole]

  • CAS No. 1003886-07-4

  • Cat. No. CS-0087848
  • Purity≥95%
  • MDL No.MFCD32639830

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

(4S,​4'S)​-2,​2'-​Cyclohexylidenebis[4​,​5-​dihydro-​4-​(phenylmethyl)​oxazole]|CS-0087848

Structure of 1003886-07-4

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General Information

  • CAS No. 1003886-07-4
  • Cat. No. CS-0087848
  • Purity ≥95%
  • MDL No. MFCD32639830
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₆H₃₀N₂O₂
  • Molecular Weight 402.53
  • Synonym(s) (4S,4'S)-2,2'-(Cyclohexane-1,1-diyl)bis(4-benzyl-4,5-dihydrooxazole)
  • SMILES C1(C2(CCCCC2)C3=N[C@@H](CC4=CC=CC=C4)CO3)=N[C@@H](CC5=CC=CC=C5)CO1

Description

This chiral bisoxazole features a rigid cyclohexylidene bridge linking two 4-phenylmethyl-4,5-dihydrooxazole units, offering high structural stability and defined stereochemistry. The scaffold integrates electron-rich heterocycles with steric control, enabling use in asymmetric synthesis and molecular recognition applications.

Application

(4S,4'S)-2,2'-Cyclohexylidenebis[4,5-dihydro-4-(phenylmethyl)oxazole] serves as a chiral bis-oxazole scaffold with defined stereochemistry, enabling controlled spatial orientation in asymmetric synthesis. Its robust cyclohexylidene linker provides conformational rigidity and enhanced stability, while the benzylic oxazole moieties offer orthogonal reactivity for downstream functionalization. The structure facilitates efficient metal coordination and demonstrates favorable handling characteristics, making it a practical building block for complex heterocyclic systems and catalyst design.

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   5.0169
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   6

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