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The molecular formula is C18H26O4.
The structure was created on 2007-12-05 and last modified on 2023-12-30.
The IUPAC Name is (2-hexanoyloxyphenyl) hexanoate.
The InChIKey is ROYLHNCAKTYWLD-UHFFFAOYSA-N.
The Canonical SMILES is CCCCCC(=O)OC1=CC=CC=C1OC(=O)CCCCC.
The molecular weight is 306.4 g/mol.
There are 4 hydrogen bond acceptors.
The Rotatable Bond Count is 12.
The Topological Polar Surface Area is 52.6 Å2.
Yes, the compound is canonicalized.
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