283831 <common-name>(4,4-dicarboxy-2-hydroxy-4-phenylbutyl)mercury</common-name> <description>(4,4-dicarboxy-2-hydroxy-4-phenylbutyl)mercury belongs to the benzene and substituted derivatives, a class of benzenoids within the organic compounds. This compound has the chemical formula C12H13HgO5 and an average molecular weight of 437.82 g/mol.</description> <cas nil="true"/> <pubchem-id>45468</pubchem-id> <chemical-formula>C12H13HgO5</chemical-formula> <weight>437.82</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-27T19:26:33Z</created-at> <updated-at type="dateTime">2026-08-27T19:26:33Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>C1=CC=C(C=C1)C(CC(C[Hg])O)(C(=O)O)C(=O)O</moldb-smiles> <moldb-formula>C12H13HgO5</moldb-formula> <moldb-inchi>InChI=1S/C12H13O5.Hg/c1-8(13)7-12(10(14)15,11(16)17)9-5-3-2-4-6-9;/h2-6,8,13H,1,7H2,(H,14,15)(H,16,17);</moldb-inchi> <moldb-inchikey>MXLYXWCYRZSZFK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">439.046942</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM279724</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>(4,4-dicarboxy-2-hydroxy-4-phenylbutyl)mercury</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0235737</sync-id> <structure-inchikey>MXLYXWCYRZSZFK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000080000000000000800000002000000000000000000000000000100000000000000000000000000000000000000004000000000000000000004000000000000000000000000000000000000000000020000000000100000000000000000000000000010000400000000000000000000000000000000000000000000000000000000000000000800020000000020000000000000100000000000000000000000000000000000000000000080000000040000000000000000000000010000000000000000200000000000000000000000000000000000000000200000000008000000000000000010040000000040400000000000000400000000040000200</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAASAAAAEgAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGACAAAAAE BgBgAAAAAgIGAGAAAAADAQYAYAAAAAICUCAoAAAAAQEIAGAAAAABAQYAKAAA AAMECAAoAAAAAwIIAGgAAAADAQEGACgAAAADBAgAKAAAAAMCCABoAAAAAwEB CwABaAwBAmgMAgNoDAMEaAwEBWgMAwYABgcABwgACAkACQoACAsABgwADA0o AgwOIAYPAA8QKAIPESAFAGgMQgEAAAAGAAUEAwIBFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:58:17Z</structure-indexed-at> </compound>