93642 <common-name>1,2,3,4,7,7-Hexachloro-5-(tribromophenyl)bicyclo[2.2.1]hept-2-ene</common-name> <description>1,2,3,4,7,7-Hexachloro-5-(tribromophenyl)bicyclo[2.2.1]hept-2-ene belongs to the halobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. It is categorized under the benzenoids superclass and has the chemical formula C13H5Br3Cl6. With an average molecular weight of 613.60 g/mol, 1,2,3,4,7,7-Hexachloro-5-(tribromophenyl)bicyclo[2.2.1]hept-2-ene is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>21116839</pubchem-id> <chemical-formula>C13H5Br3Cl6</chemical-formula> <weight nil="true"/> <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">2026-04-05T02:14:49Z</created-at> <updated-at type="dateTime">2026-04-05T02:14:49Z</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>ClC1=C(Cl)C2(Cl)C(CC1(Cl)C2(Cl)Cl)C1=C(Br)C=C(Br)C=C1Br</moldb-smiles> <moldb-formula>C13H5Br3Cl6</moldb-formula> <moldb-inchi>InChI=1/C13H5Br3Cl6/c14-6-2-1-4(7(15)8(6)16)5-3-11(19)9(17)10(18)12(5,20)13(11,21)22/h1-2,5H,3H2</moldb-inchi> <moldb-inchikey>KQTUTUFFRWMPMY-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">613.6</moldb-average-mass> <moldb-mono-mass type="decimal">607.6072525</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>CHEM089535</chemdb-id> <dsstox-id>DTXSID30972327</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00055273</susdat-id> <iupac nil="true"/> <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>Halobenzenes</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0167101</sync-id> <structure-inchikey>MVQRAJZAYJHOAS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000000000080000000000000000020000000000000008000000000000000000000000000000000000000000000000000000000000400000000000000000000000000801000100001000800000000400000000008000004000000000100000000400020000000000000000000000100000000408000000000000000100000000000000000000000880000000000000000000000000000000000000080000000000000000000000000000000000000000000000000000000000000100008000000010000000000000000000000000000000000000800000000040000000080000080002000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAWAAAAGAAAAIABEQAgAAAAAQYAKAAAAAME BgAoAAAAAwQRACAAAAABBgAgAAAABBEAIAAAAAEGAGAAAAADAQYAYAAAAAIC BgAgAAAABBEAIAAAAAEGACAAAAAEEQAgAAAAAREAIAAAAAEGQCgAAAADBAZA KAAAAAMEIwAgAAAAAQZAaAAAAAMDAQZAKAAAAAMEIwAgAAAAAQZAaAAAAAMD AQZAKAAAAAMEIwAgAAAAAQsAAQABAggCAgMAAgQABAUABAYABgcABwgACAkA CAoACgsACgwABg0ADQ5oDA4PAA4QaAwQEWgMERIAERNoDBMUaAwUFQAIAQAU DWgMCgQAQgMAAAAFAQIECggFBwYECggGDhARExQNFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:35:17Z</structure-indexed-at> </compound>