65014 <common-name>3-(4-Fluorophenyl)-3-oxopropanamide</common-name> <description>3-(4-Fluorophenyl)-3-oxopropanamide belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. This organic oxygen compound has the formula C9H8F1N1O2 and an average molecular weight of 181.17 g/mol.</description> <cas>671188-82-2</cas> <pubchem-id>2806066</pubchem-id> <chemical-formula>C9H8F1N1O2</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">2026-04-03T03:28:03Z</created-at> <updated-at type="dateTime">2026-04-03T03:28:03Z</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>NC(=O)CC(=O)C1=CC=C(F)C=C1</moldb-smiles> <moldb-formula>C9H8F1N1O2</moldb-formula> <moldb-inchi>InChI=1S/C9H8FNO2/c10-7-3-1-6(2-4-7)8(12)5-9(11)13/h1-4H,5H2,(H2,11,13)</moldb-inchi> <moldb-inchikey>OCMBRGOMXXXXHT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">181.166</moldb-average-mass> <moldb-mono-mass type="decimal">181.053907</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>2084588</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>CHEM060907</chemdb-id> <dsstox-id>DTXSID20384475</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00017316</susdat-id> <iupac>3-(4-fluorophenyl)-3-oxopropanamide</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>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbonyl compounds</subklass> <paper-count type="integer">1</paper-count> <sync-id>CED0070745</sync-id> <structure-inchikey>OCMBRGOMXXXXHT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>802000000000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000020000000000010000000000000000000000000010000000000000000000000000000000000000000000000000000000000000000000000000000000000000080001000000000000000000000000000000000000000000000000000084000002000000000000000000000000000000000000000000000000000200020000000030000044000000000000200000000002000000000000000000040000020000400800000000000000000000000000000</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���h�B�������� ������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:16:31Z</structure-indexed-at> </compound>