1476-23-9 Purity
97%
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Specification
This article investigated the hydrogenation rate of 6-ethyl-1,2,3,4-tetrahydroanthracene-9,10-dione in 20 solvents at 313 K and 0.1 MPa with supported palladium catalysts. In particular, the model reaction is the selective hydrogenation of 6-ethyl-1,2,3,4-tetrahydroanthracene-9,10-dione to 6-ethyl-1,2,3,4-tetrahydroanthracene-9,10-diol. The hydrogenation kinetics were studied in 20 component solvents including alcohols, aromatics, alkanes, ethers, esters, amines, and alkyl chlorides.
The rate of reaction was regressed by Abraham-Kamlet-Taft (AKT) and Koppel-Palm (KP), and it turns out that basic solvent properties and its Hildebrand cohesive energy density determine the hydrogenation rate. The most important parameter in the AKT model is the hydrogen bond acceptor ability of the solvent, while the most important parameter in the KP model is the nucleophilic solvation ability of the solvent. These results help to choose solvents in industrial hydrogen peroxide production by anthraquinone using the kinetics of hydrogenation by anthraquinone.
The molecular formula is C16H16O2.
Some synonyms include 15547-17-8, Tetrahydro-2-ethylanthraquinone, and 2-Ethyl-5,6,7,8-tetrahydroanthraquinone.
The molecular weight is 240.30 g/mol.
The IUPAC name is 6-ethyl-1,2,3,4-tetrahydroanthracene-9,10-dione.
The InChIKey is PXLXSNXYTNRKFR-UHFFFAOYSA-N.
It has 0 hydrogen bond donor counts.
The XLogP3-AA value is 3.6.
The topological polar surface area is 34.1?2.
The exact mass is 240.115029749 g/mol.
It has 1 rotatable bond count.