67243 <common-name>2,5-Dibromotoluene</common-name> <description>2,5-Dibromotoluene is an organic compound with the formula C7H6Br2 and an average molecular weight of 249.93 g/mol. 2,5-Dibromotoluene belongs to the halobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. In terms of broader chemical classification, it is categorized under the superclass of benzenoids. The compound has been identified in or released from three recorded sources. These include food preservation within the sector of food, food processing and cookware, as well as electrical and electronic equipment, specifically antennas, conductors or conductive bodies characterised by the conductive materials.</description> <cas>615-59-8</cas> <pubchem-id>12006</pubchem-id> <chemical-formula>C7H6Br2</chemical-formula> <weight>249.93</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">2026-04-03T09:04:26Z</created-at> <updated-at type="dateTime">2026-08-24T03:42:51Z</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>CC1=CC(Br)=CC=C1Br</moldb-smiles> <moldb-formula>C7H6Br2</moldb-formula> <moldb-inchi>InChI=1S/C7H6Br2/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3</moldb-inchi> <moldb-inchikey>QKEZTJYRBHOKHH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">249.933</moldb-average-mass> <moldb-mono-mass type="decimal">247.883626</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.3</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>11511</chemspider-id> <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>CHEM063136</chemdb-id> <dsstox-id>DTXSID1050389</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00021251</susdat-id> <iupac>1,4-dibromo-2-methylbenzene</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>Halobenzenes</subklass> <paper-count type="integer">4</paper-count> <sync-id>CED0045094</sync-id> <structure-inchikey>QKEZTJYRBHOKHH-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000000000000000000000000000000000000000000000000000000010000000000000000000000000000000000000000000800000000200020000000000004000000000100000000400000000000000000000000000000000000040000000000000000000000004000000000000000040000000000000000000000000000000000000080100000000000000000000000000000000000000000000000000000000000100000000000000000000002000000200000000000000000000000000000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>102000000000000000820000000000002040000002420c002000004c000000000800000000001000080000204200020008c20010080442004a0000080110000020000080000000000620000000001004000212200000020000000000c2004040040020000000000401000002000801000010004110800000091000200400008044000000800020008000010100c0202440010800000080000000000000520000000400000002800003c201002c0000008400840100000000000021000000004040000100180000000010000000000000000400000000000080001000000000000010000000000000002000000000000004000020000000050000000</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAJAAAACQAAAIABBgBgAAAAAQMGQCgAAAAD BAZAaAAAAAMDAQZAKAAAAAMEIwAgAAAAAQZAaAAAAAMDAQZAaAAAAAMDAQZA KAAAAAMEIwAgAAAAAQsAAQABAmgMAgNoDAMEAAMFaAwFBmgMBgdoDAcIAAcB aAxCAQAAAAYBBwYFAwIXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:17:34Z</structure-indexed-at> </compound>