98389 <common-name>[[Pentakis(bromomethyl)phenyl]methyl]triphenylphosphonium bromide</common-name> <description>[[Pentakis(bromomethyl)phenyl]methyl]triphenylphosphonium bromide belongs to the phenylphosphines and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It is classified as a benzenoid with the chemical formula C30H27Br5P. With an average molecular weight of 897.94 g/mol, [[Pentakis(bromomethyl)phenyl]methyl]triphenylphosphonium bromide is a heavy molecule.</description> <cas>83929-72-0</cas> <pubchem-id>3019504</pubchem-id> <chemical-formula>C30H27Br5P</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">2026-04-05T06:02:31Z</created-at> <updated-at type="dateTime">2026-04-05T06:02:31Z</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>[Br-].BrCC1=C(CBr)C(CBr)=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C(CBr)=C1CBr</moldb-smiles> <moldb-formula>C30H27Br5P</moldb-formula> <moldb-inchi>InChI=1/C30H27Br5P.BrH/c31-16-25-26(17-32)28(19-34)30(29(20-35)27(25)18-33)21-36(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24;/h1-15H,16-21H2;1H/q+1;/p-1</moldb-inchi> <moldb-inchikey>VYSBPBFVWUKOFT-UHFFFAOYSA-M</moldb-inchikey> <moldb-average-mass type="decimal">897.944</moldb-average-mass> <moldb-mono-mass type="decimal">812.776723</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>CHEM094282</chemdb-id> <dsstox-id>DTXSID501004111</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00060925</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>Phenylphosphines and derivatives</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0111669</sync-id> <structure-inchikey>VYSBPBFVWUKOFT-UHFFFAOYSA-M</structure-inchikey> <structure-fingerprint>40008000000000000001800000000010000000000000000000000000200000100000000000000000000000000000000004000000000000000000000000000000000000000000000000000000000000000000000000000000000000800000000000080000000000000000000000000000000000000000000000000000000000000000000000040000800200000000000000000000000100000000000000000000000400000000000000000000080000004000000000000000000000000000000000000000000000000000000000000000000000000000000000000200000000000000000000020000000044000000000000000200000000000000000000002000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAlAAAAJwAAAIABIyACAAAA/yMAIAAAAAEG AGAAAAACAgZAKAAAAAMEBkAoAAAAAwQGAGAAAAACAiMAIAAAAAEGQCgAAAAD BAYAYAAAAAICIwAgAAAAAQZAKAAAAAMEBgBgAAAAAgIPICIAAAABBAZAKAAA AAMEBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAA AwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEGQGgAAAAD AwEGQGgAAAADAwEGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMD AQZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBgBgAAAAAgIjACAAAAABBkAo AAAAAwQGAGAAAAACAiMAIAAAAAELAQIAAgMAAwRoDAQFAAUGAAQHaAwHCAAI CQAHCmgMCgsACwwADA0ADQ5oDA4PaAwPEGgMEBFoDBESaAwMEwATFGgMFBVo DBUWaAwWF2gMFxhoDAwZABkaaAwaG2gMGxxoDBwdaAwdHmgMCh9oDB8gACAh AB8iaAwiIwAjJAAiA2gMEg1oDBgTaAweGWgMQgQAAAAGAyIfCgcEBg4PEBES DQYUFRYXGBMGGhscHR4ZFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:38:10Z</structure-indexed-at> </compound>