Benzyl 5-hydroxy-4-oxapenta­cyclo­[5.4.1.02,6.03,10.08,11]dodecane-3-carboxyl­ate
2011

Structure of Benzyl 5-hydroxy-4-oxapentacyclododecane-3-carboxylate

publication Evidence: high

Author Information

Author(s): Karpoormath Rajshekhar, Naicker Tricia, Govender Thavendran, Kruger Hendrik G., Maguire Glenn E. M.

Primary Institution: University of KwaZulu-Natal

Conclusion

The compound exhibits a long C—C bond and forms centrosymmetric dimers through hydrogen bonding.

Supporting Evidence

  • The title compound exhibits a long C—C bond of 1.575 Å.
  • Hydrogen bonds link the molecules into centrosymmetric dimers.
  • The study provides the first X-ray structure report of a PCU derivative containing ether, ester, and primary alcohol functional groups.

Takeaway

This study looks at a special molecule that has a unique structure and how its parts connect together.

Methodology

Single-crystal X-ray diffraction was used to determine the structure.

Digital Object Identifier (DOI)

10.1107/S1600536811009020

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