96122-61-1 Purity
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The IUPAC name of the compound is (2S)-2-[(3,5-dinitrobenzoyl)amino]-2-phenylacetic acid.
The molecular formula of the compound is C15H11N3O7.
The molecular weight of the compound is 345.26 g/mol.
The CAS number of the compound is 90761-62-9.
The InChIKey of the compound is MIVUDAUOXJDARR-ZDUSSCGKSA-N.
The XLogP3-AA value of the compound is 2.1.
The compound has 2 hydrogen bond donor counts.
The compound has 7 hydrogen bond acceptor counts.
The compound has 4 rotatable bond counts.
Yes, the compound is canonicalized.