284685 <common-name>3-(2-prop-2-enoxyphenoxy)propane-1,2-diol</common-name> <description>3-(2-prop-2-enoxyphenoxy)propane-1,2-diol belongs to the phenol ethers, a class of benzenoids within the organic compounds. This compound has the formula C12H16O4 and an average molecular weight of 224.25 g/mol.</description> <cas>6452-54-6</cas> <pubchem-id>110856</pubchem-id> <chemical-formula>C12H16O4</chemical-formula> <weight>224.25</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">2026-08-27T20:19:30Z</created-at> <updated-at type="dateTime">2026-08-27T20:19:30Z</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>C=CCOC1=CC=CC=C1OCC(CO)O</moldb-smiles> <moldb-formula>C12H16O4</moldb-formula> <moldb-inchi>InChI=1S/C12H16O4/c1-2-7-15-11-5-3-4-6-12(11)16-9-10(14)8-13/h2-6,10,13-14H,1,7-9H2</moldb-inchi> <moldb-inchikey>WTGJGWJJJOCUQE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">224.104859</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1</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>CHEM280578</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>3-(2-prop-2-enoxyphenoxy)propane-1,2-diol</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>Phenol ethers</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0236546</sync-id> <structure-inchikey>WTGJGWJJJOCUQE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000200000000000000000000000002100000000000000000000000000000000000000000000010000000000000000020000000000200000000000000000000000000000000200000000300000000000000000000000000010000000000000000000000000000001008000000000000000000000000000000000000800000000000000000008000000100000000000000000000000000000000000000400200080000002000000000080000000000000000000010000000000000000000000000040000000000000000000000000200000000000000000000000000000040000000000000000000100020400000000000000200</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEAAAAIABBgBoAAAAAwICBgBoAAAA AwMBBgBgAAAAAgIIACgAAAADAgZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB BkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQIACgAAAADAgYAYAAAAAICBgBg AAAAAwEGAGAAAAACAggAYAAAAAEBCABgAAAAAQELAAEIAgECAAIDAAMEIAQF aAwFBmgMBgdoDAcIaAwICWgMCQogCgsACwwADA0ADQ4ADA8ACQRoDEIBAAAA BgQJCAcGBRcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:58:53Z</structure-indexed-at> </compound>