<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">88667</id>
  <title nil="true"/>
  <common-name>4-(Allyloxy)-1-bromobenzene</common-name>
  <description>4-(Allyloxy)-1-bromobenzene is an organic compound with the formula C9H9BrO and an average molecular weight of 213.07 g/mol. 4-(Allyloxy)-1-bromobenzene belongs to the phenol ethers, a class of benzenoids within the organic compounds. This substance has been identified in or released from one recorded source: Electrical &amp; Electronic Equipment (Antennas).</description>
  <cas>25244-30-8</cas>
  <pubchem-id>257944</pubchem-id>
  <chemical-formula>C9H9BrO</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">2026-04-04T23:08:43Z</created-at>
  <updated-at type="dateTime">2026-04-04T23:08:43Z</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=C(OCC=C)C=C1</moldb-smiles>
  <moldb-formula>C9H9BrO</moldb-formula>
  <moldb-inchi>InChI=1/C9H9BrO/c1-2-7-11-9-5-3-8(10)4-6-9/h2-6H,1,7H2</moldb-inchi>
  <moldb-inchikey>ZXCVTYLZFUQVIE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">213.074</moldb-average-mass>
  <moldb-mono-mass type="decimal">211.983677</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>CHEM084560</chemdb-id>
  <dsstox-id>DTXSID60948095</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00049453</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>Phenol ethers</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0114451</sync-id>
  <structure-inchikey>ZXCVTYLZFUQVIE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800002000000000000000000000000000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000300000200800000000000000000000000000000000000000000000400001008000000000000000000000000000000000000000000000000000004000000000000000000000000000000000000000000000000000200080000000000000000080000000000000000000010000000000000000000000100044000000000000000000000000200000000000000000000000000000040000008000000000000100000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAALAAAACwAAAIABIwAgAAAAAQZAKAAAAAME
BkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQIACgAAAADAgYAYAAAAAICBgBo
AAAAAwMBBgBoAAAAAwICBkBoAAAAAwMBBkBoAAAAAwMBCwABAAECaAwCA2gM
AwRoDAQFIAUGAAYHAAcICAIECWgMCQpoDAoBaAxCAQAAAAYBCgkEAwIXBAAA
AAAAAAAW
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:32:15Z</structure-indexed-at>
</compound>
