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The molecular formula of the compound is C18H26O4.
The compound was created on February 29, 2008, and modified on December 30, 2023.
The IUPAC name of the compound is 5-(4-heptoxyphenyl)-5-oxopentanoic acid.
The InChI of the compound is InChI=1S/C18H26O4/c1-2-3-4-5-6-14-22-16-12-10-15(11-13-16)17(19)8-7-9-18(20)21/h10-13H,2-9,14H2,1H3,(H,20,21).
The InChIKey of the compound is FSKCXSYGBLWGTC-UHFFFAOYSA-N.
The canonical SMILES of the compound is CCCCCCCOC1=CC=C(C=C1)C(=O)CCCC(=O)O.
The molecular weight of the compound is 306.4 g/mol.
The compound has 4 hydrogen bond acceptor counts.
The topological polar surface area of the compound is 63.6?2.
Yes, the compound is canonicalized according to PubChem.
898792-15-9
898792-16-0
898792-17-1
898792-19-3
898792-20-6
898792-21-7
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