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A resorcin[4]arene hexameric capsule as a supramolecular catalyst in elimination and isomerization reactions

Tommaso Lorenzetto, Fabrizio Fabris and Alessandro Scarso

Beilstein J. Org. Chem. 2022, 18, 337–349. https://doi.org/10.3762/bjoc.18.38

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Chemical structure C<sub>10</sub>H<sub>18</sub>O

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Extracted from

Scheme 2

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₀H₁₈O
Molecular Weight	154.25 g/mol
Exact Mass	154.1358 Da
InChI	InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10-/m0/s1
InChIKey	ZYTMANIQRDEHIO-AEJSXWLSSA-N
SMILES	C=C(C)[C@H]1CC[C@H](C)C[C@@H]1O
Number of Atoms	29
Number of H-Bond Acceptors	1
Number of H-Bond Donors	1
Atoms in the Largest π-System	1
XLogP	2.4

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