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The molecular formula of the compound is C13H18O3.
The molecular weight of the compound is 222.28 g/mol.
The IUPAC name of the compound is 5-(2,5-dimethylphenoxy)pentanoic acid.
The InChI code of the compound is InChI=1S/C13H18O3/c1-10-6-7-11(2)12(9-10)16-8-4-3-5-13(14)15/h6-7,9H,3-5,8H2,1-2H3,(H,14,15).
The InChIKey of the compound is GDELSTPAOVZJKB-UHFFFAOYSA-N.
The canonical SMILES of the compound is CC1=CC(=C(C=C1)C)OCCCCC(=O)O.
The ChEMBL ID of the compound is CHEMBL4859323.
The XLogP3-AA value of the compound is 2.8.
The compound has 1 hydrogen bond donor count.
The compound has 6 rotatable bond count.
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