305319 <common-name>6-methoxy-2-[(e)-2-nitroethenyl]-3-phenyl-1-benzofuran</common-name> <description>6-methoxy-2-[(e)-2-nitroethenyl]-3-phenyl-1-benzofuran belongs to the phenylbenzofurans, a subclass of benzofurans within the organic compounds. It is categorized as an organoheterocyclic compound with the chemical formula C17H13NO4 and an average molecular weight of 295.29 g/mol.</description> <cas>37733-65-6</cas> <pubchem-id>6445615</pubchem-id> <chemical-formula>C17H13NO4</chemical-formula> <weight>295.29</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">2026-08-28T22:52:19Z</created-at> <updated-at type="dateTime">2026-08-28T22:52:19Z</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>COC1=CC2=C(C=C1)C(=C(O2)C=C[N+](=O)[O-])C3=CC=CC=C3</moldb-smiles> <moldb-formula>C17H13NO4</moldb-formula> <moldb-inchi>InChI=1S/C17H13NO4/c1-21-13-7-8-14-16(11-13)22-15(9-10-18(19)20)17(14)12-5-3-2-4-6-12/h2-11H,1H3/b10-9+</moldb-inchi> <moldb-inchikey>CFTRVURMWPKSNG-MDZDMXLPSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">295.0844579</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.2</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>CHEM301212</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>6-methoxy-2-[(e)-2-nitroethenyl]-3-phenyl-1-benzofuran</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>Organoheterocyclic compounds</superklass> <klass>Benzofurans</klass> <subklass>Phenylbenzofurans</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0256423</sync-id> <structure-inchikey>CFTRVURMWPKSNG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2080000000000000000000000000000002000000000000000000000000000000008000200000000000000004000200000000000000000000000000000000000000000000000000000080000020800000000300001200008100408000040001000000001240000000100000000000000000000000000000000000000020000040000000800000000000000000800000000100000000000000000000000000000000000000040000080000000000000000000100010000000000000080000000000000000800000000000000000000000000000004001200000000000010800000000000000040000000000000000000001008000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������(������@(������@h�������@(������@(������@h�������@h�������@(������@(������@(�������h��������h������� *��������(������ *���ÿ���@(������@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">2026-09-19T05:14:06Z</structure-indexed-at> </compound>