CAS
16789-98-3 Purity
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16789-98-3 Purity
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Specification
The molecular formula is C14H13NO5.
It was created on December 5, 2007, and last modified on December 30, 2023.
The IUPAC name is methyl 2-[(1,3-dioxoisoindol-2-yl)methyl]-3-oxobutanoate.
The InChIKey is IFVZJAWLFZULFV-UHFFFAOYSA-N.
It has 5 hydrogen bond acceptor counts.
The exact mass is 275.07937252 g/mol.
It has 5 rotatable bond counts.
The topological polar surface area is 80.8?2.
It has 20 heavy atom counts.
Yes, it is a canonicalized compound.