89061 <common-name>4-Bromo-1-naphthylamine</common-name> <description>4-Bromo-1-naphthylamine belongs to the naphthalenes, a class of benzenoids within the organic compounds. It has the chemical formula C10H8BrN and an average molecular weight of 222.09 g/mol.</description> <cas>2298-07-9</cas> <pubchem-id>75303</pubchem-id> <chemical-formula>C10H8BrN</chemical-formula> <weight>222.08</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">2026-04-04T23:29:41Z</created-at> <updated-at type="dateTime">2026-08-18T04:54:40Z</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>NC1=CC=C(Br)C2=CC=CC=C12</moldb-smiles> <moldb-formula>C10H8BrN</moldb-formula> <moldb-inchi>InChI=1/C10H8BrN/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6H,12H2</moldb-inchi> <moldb-inchikey>LIUKLAQDPKYBCP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">222.085</moldb-average-mass> <moldb-mono-mass type="decimal">220.9840114</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</logp> <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>CHEM084954</chemdb-id> <dsstox-id>DTXSID00177524</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00049899</susdat-id> <iupac>4-bromonaphthalen-1-amine</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>Naphthalenes</klass> <subklass nil="true"/> <paper-count type="integer">5</paper-count> <sync-id>CED0043029</sync-id> <structure-inchikey>LIUKLAQDPKYBCP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000004000000000000000000800000000000000000000000004000000008000000000200000000000000000000000000000000000000000000800000000000000000001000000100000040000000000020000000000000000000042000080000000000000000004000000000000000000000000000040000000000000100000000000000000000000000000200000000000000000000000000000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAMAAAADQAAAIABBwBoAAAAAwECBkAoAAAA AwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAADBCMAIAAAAAEGQCgAAAADBAZA aAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMECwAB IAECaAwCA2gMAwRoDAQFAAQGaAwGB2gMBwhoDAgJaAwJCmgMCgtoDAsBaAwL BmgMQgIAAAAGAQsGBAMCBgcICQoLBhcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:32:29Z</structure-indexed-at> </compound>