108732 <common-name>2,4,6-Tribromodiphenyl ether</common-name> <description>2,4,6-Tribromodiphenyl ether belongs to the diphenylethers, a subclass of benzene and substituted derivatives within the organic compounds. It is categorized under the superclass of benzenoids. This compound has the chemical formula C12H7Br3O and an average molecular weight of 406.90 g/mol.</description> <cas>155999-95-4</cas> <pubchem-id>12073149</pubchem-id> <chemical-formula>C12H7Br3O</chemical-formula> <weight>406.89</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">2026-04-05T16:39:44Z</created-at> <updated-at type="dateTime">2026-04-16T23:02:10Z</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>BrC1=CC(Br)=C(OC2=CC=CC=C2)C(Br)=C1</moldb-smiles> <moldb-formula>C12H7Br3O</moldb-formula> <moldb-inchi>InChI=1S/C12H7Br3O/c13-8-6-10(14)12(11(15)7-8)16-9-4-2-1-3-5-9/h1-7H</moldb-inchi> <moldb-inchikey>TVZAPPGLBLTACB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">406.899</moldb-average-mass> <moldb-mono-mass type="decimal">403.8047011</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>CHEM104625</chemdb-id> <dsstox-id>DTXSID60477017</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00077079</susdat-id> <iupac>1,3,5-Tribromo-2-phenoxybenzene</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>Diphenylethers</subklass> <paper-count type="integer">3</paper-count> <sync-id>CED0048944</sync-id> <structure-inchikey>TVZAPPGLBLTACB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000020000000000000000200400000000000004000000004000000000000000000000000000000000200000000000000000000000000000000100000000800000000000000000000000004000000000100000000400000000000000000000000000000000000000000000800000000000000000000000000100000000000000000000000000002000000000000000080000000000000000000000400000000000000000000000000000000000400100000000000000000000000000000200000000000000000000000000000040000000000000080000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEQAAAIABIwAgAAAAAQZAKAAAAAME BkBoAAAAAwMBBkAoAAAAAwQjACAAAAABBkAoAAAAAwQIACgAAAADAgZAKAAA AAMEBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAA AwMBBkAoAAAAAwQjACAAAAABBkBoAAAAAwMBCwABAAECaAwCA2gMAwQAAwVo DAUGIAYHIAcIaAwICWgMCQpoDAoLaAwLDGgMBQ1oDA0OAA0PaAwPAWgMDAdo DEICAAAABgEPDQUDAgYICQoLDAcXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:43:15Z</structure-indexed-at> </compound>