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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/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3/t10-/m0/s1
InChIKey	NEHNMFOYXAPHSD-JTQLQIEISA-N
SMILES	CC(=CCC[C@H](C)CC([H])=O)C
Number of Atoms	29
Number of H-Bond Acceptors	1
Number of H-Bond Donors	0
Atoms in the Largest π-System	2
XLogP	3.6

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