18645 <common-name>Benzyl bromoacetate</common-name> <description nil="true"/> <cas>5437-45-6</cas> <pubchem-id>62576</pubchem-id> <chemical-formula>C9H9BrO2</chemical-formula> <weight>229.07</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">2016-05-22T04:27:02Z</created-at> <updated-at type="dateTime">2026-04-17T17:40:24Z</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>BrCC(=O)OCC1=CC=CC=C1</moldb-smiles> <moldb-formula>C9H9BrO2</moldb-formula> <moldb-inchi>InChI=1S/C9H9BrO2/c10-6-9(11)12-7-8-4-2-1-3-5-8/h1-5H,6-7H2</moldb-inchi> <moldb-inchikey>JHVLLYQQQYIWKX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">229.073</moldb-average-mass> <moldb-mono-mass type="decimal">227.978593</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>56338</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>CHEM017540</chemdb-id> <dsstox-id>DTXSID4040343</dsstox-id> <toxcast-id>40343</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00021204</susdat-id> <iupac>benzyl 2-bromoacetate</iupac> </compound>