81078 <common-name>Ethyl 3-(3-fluoro-4-hydroxyphenyl)propionate</common-name> <description>Ethyl 3-(3-fluoro-4-hydroxyphenyl)propionate belongs to the halophenols, a subclass of phenols within the organic compounds. This benzenoid compound has the chemical formula C11H13F1O3 and an average molecular weight of 212.22 g/mol.</description> <cas>94139-03-4</cas> <pubchem-id>3023769</pubchem-id> <chemical-formula>C11H13F1O3</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">2026-04-04T17:07:18Z</created-at> <updated-at type="dateTime">2026-04-04T17:07:18Z</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>CCOC(=O)CCC1=CC(F)=C(O)C=C1</moldb-smiles> <moldb-formula>C11H13F1O3</moldb-formula> <moldb-inchi>InChI=1S/C11H13FO3/c1-2-15-11(14)6-4-8-3-5-10(13)9(12)7-8/h3,5,7,13H,2,4,6H2,1H3</moldb-inchi> <moldb-inchikey>NZRVUWDDVNJOHS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">212.22</moldb-average-mass> <moldb-mono-mass type="decimal">212.084872</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>2289856</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>CHEM076971</chemdb-id> <dsstox-id>DTXSID90240796</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00040165</susdat-id> <iupac>ethyl 3-(3-fluoro-4-hydroxyphenyl)propanoate</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>Phenols</klass> <subklass>Halophenols</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0157613</sync-id> <structure-inchikey>NZRVUWDDVNJOHS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000800002000010000000000000000000000000000000000002000200000000000000000000000000000000000000000000000008000000000000000000000000000000000020000004000110000000000000000000000000010000100000000000100000000000000000000000000000000000000000020040000000200000000000000000000000000000000000021000000000000000000000000000000000082000000000000000000000100000000000000000000008000000002100000000000000000000000000002000000220000000000000000000008000000040000000000400800000000000000000000000004000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(�������`�������`������@(������@h�������@(����� � �����@(�������h�������@h�������@h��������������� ��(������������h�� h� � �h��� � h� �h���h�B������� � �����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:27:50Z</structure-indexed-at> </compound>