<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">310782</id>
  <title nil="true"/>
  <common-name>3-(4-fluorophenyl)-7-propan-2-yloxychromen-4-one</common-name>
  <description>3-(4-fluorophenyl)-7-propan-2-yloxychromen-4-one is a chemical compound with the formula C18H15FO3. It has an average molecular weight of 298.30 g/mol.</description>
  <cas>131814-58-9</cas>
  <pubchem-id>746742</pubchem-id>
  <chemical-formula>C18H15FO3</chemical-formula>
  <weight>298.3</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">2026-08-29T06:26:19Z</created-at>
  <updated-at type="dateTime">2026-08-29T06:26:19Z</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>CC(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=C(C=C3)F</moldb-smiles>
  <moldb-formula>C18H15FO3</moldb-formula>
  <moldb-inchi>InChI=1S/C18H15FO3/c1-11(2)22-14-7-8-15-17(9-14)21-10-16(18(15)20)12-3-5-13(19)6-4-12/h3-11H,1-2H3</moldb-inchi>
  <moldb-inchikey>BZTQIVBTNKHMHV-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">298.1005225</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.1</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>CHEM306675</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-(4-fluorophenyl)-7-propan-2-yloxychromen-4-one</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>Phenylpropanoids and polyketides</superklass>
  <klass>Isoflavonoids</klass>
  <subklass>Isoflav-2-enes</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0261750</sync-id>
  <structure-inchikey>BZTQIVBTNKHMHV-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000020000002000000000000000000000000000000002000000000000001000008020200000008000000080000000000000000000400000000000000400000010000000000000000000000020808000002110000200000000000000000000000000000000000000100000800000000004000000000000000000000000000040000000000000000000000000800000000000000000400000040000000000000000000000040000080000002000000000000000000000000000000000000000000000000000000000000000020000000000000004000200000000000010800000000000000040000000000400800000000000200000000000000040</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���h��	h��
h�
�(�
�h��h��h��� ��h���h���h���h���h����	�h���h���h�B������	�����
���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:18:05Z</structure-indexed-at>
</compound>
