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The molecular formula is C13H14O3.
The synonyms are 5-(3-methoxyphenyl)cyclohexane-1,3-dione, 27462-91-5, and 1,3-Cyclohexanedione, 5-(3-methoxyphenyl)-.
The molecular weight is 218.25 g/mol.
It was created on September 17, 2005.
It was last modified on November 25, 2023.
The IUPAC name is 5-(3-methoxyphenyl)cyclohexane-1,3-dione.
The InChI code is InChI=1S/C13H14O3/c1-16-13-4-2-3-9(7-13)10-5-11(14)8-12(15)6-10/h2-4,7,10H,5-6,8H2,1H3.
The InChIKey is AQUXWSRUHWNKNU-UHFFFAOYSA-N.
The canonical SMILES is COC1=CC=CC(=C1)C2CC(=O)CC(=O)C2.
The XLogP3-AA value is 1.3.
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